4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine

C19H20FN7 — CID 122681038

IUPAC4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine
SMILESC[C@@H]1c2cnc(-c3ncccn3)nc2CCN1c1cc(F)cc(N(C)C)n1
InChIInChI=1S/C19H20FN7/c1-12-14-11-23-19(18-21-6-4-7-22-18)24-15(14)5-8-27(12)17-10-13(20)9-16(25-17)26(2)3/h4,6-7,9-12H,5,8H2,1-3H3/t12-/m1/s1
InChIKeyGEZSCOAOQFCVLY-GFCCVEGCSA-N
MW365.42 g/mol
LogP2.66
Rot. Bonds3

About 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine

4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine (PubChem CID 122681038) has the molecular formula C19H20FN7 and a molecular weight of 365.42 g/mol. Its IUPAC name is 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine.

Molecular Properties

Compound Name4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine
PubChem CID122681038
Molecular FormulaC19H20FN7
Molecular Weight365.42 g/mol
Exact Mass365.18
IUPAC Name4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine
SMILESC[C@@H]1c2cnc(-c3ncccn3)nc2CCN1c1cc(F)cc(N(C)C)n1
InChIInChI=1S/C19H20FN7/c1-12-14-11-23-19(18-21-6-4-7-22-18)24-15(14)5-8-27(12)17-10-13(20)9-16(25-17)26(2)3/h4,6-7,9-12H,5,8H2,1-3H3/t12-/m1/s1
InChIKeyGEZSCOAOQFCVLY-GFCCVEGCSA-N
XLogP2.66
TPSA70.93 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.42
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

1-[4-[4-fluoro-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]piperazin-1-yl]ethanone
CID 139367423
N-[4-fluoro-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]methanesulfonamide
CID 122669814
6-[4-fluoro-6-(3-methyl-4-methylsulfinylpiperazin-1-yl)-2-pyridinyl]-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 146519390
(5S)-6-(6-fluoro-4-methoxy-2-pyridinyl)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 122681023
6-(2,6-difluoro-4-pyridinyl)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 139381324
6-(3-fluoro-5-methoxyphenyl)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 122669791
4-[4-fluoro-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]-2-(methoxymethyl)morpholine
CID 139381247
1-[1-[4-fluoro-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]azetidin-3-yl]-2-methylsulfonylethanone
CID 159094999
6-(4-fluoro-6-methoxy-2-pyridinyl)-5-methoxy-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 122669671
6-[6-fluoro-4-(4-methylsulfanylpiperazin-1-yl)-2-pyridinyl]-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 146519308
tert-butyl N-[1-[4-fluoro-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]piperidin-4-yl]carbamate
CID 139367490
[1-[2-fluoro-6-(5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-4-pyridinyl]azetidin-3-yl]methanol
CID 139367488

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine?
The IUPAC name of 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine (CID 122681038) is 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine.
What is the SMILES notation for 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine?
The canonical SMILES for 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine is C[C@@H]1c2cnc(-c3ncccn3)nc2CCN1c1cc(F)cc(N(C)C)n1.
What is the InChIKey of 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine?
The InChIKey is GEZSCOAOQFCVLY-GFCCVEGCSA-N. The full InChI is InChI=1S/C19H20FN7/c1-12-14-11-23-19(18-21-6-4-7-22-18)24-15(14)5-8-27(12)17-10-13(20)9-16(25-17)26(2)3/h4,6-7,9-12H,5,8H2,1-3H3/t12-/m1/s1.
What are the key properties of 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine?
4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine has a molecular weight of 365.42 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N,N-dimethyl-6-[(5R)-5-methyl-2-pyrimidin-2-yl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl]pyridin-2-amine is sourced from PubChem (CID 122681038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).