N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine

C19H21N7 — CID 126919209

IUPACN-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine
SMILESCc1nc(N(C)C2CN(c3cc4c(nn3)CCC4)C2)c2cccnc2n1
InChIInChI=1S/C19H21N7/c1-12-21-18-15(6-4-8-20-18)19(22-12)25(2)14-10-26(11-14)17-9-13-5-3-7-16(13)23-24-17/h4,6,8-9,14H,3,5,7,10-11H2,1-2H3
InChIKeyVUNPMJLBTWBEGC-UHFFFAOYSA-N
MW347.43 g/mol
LogP1.94
Rot. Bonds3

About N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine

N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine (PubChem CID 126919209) has the molecular formula C19H21N7 and a molecular weight of 347.43 g/mol. Its IUPAC name is N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine
PubChem CID126919209
Molecular FormulaC19H21N7
Molecular Weight347.43 g/mol
Exact Mass347.19
IUPAC NameN-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine
SMILESCc1nc(N(C)C2CN(c3cc4c(nn3)CCC4)C2)c2cccnc2n1
InChIInChI=1S/C19H21N7/c1-12-21-18-15(6-4-8-20-18)19(22-12)25(2)14-10-26(11-14)17-9-13-5-3-7-16(13)23-24-17/h4,6,8-9,14H,3,5,7,10-11H2,1-2H3
InChIKeyVUNPMJLBTWBEGC-UHFFFAOYSA-N
XLogP1.94
TPSA70.93 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.43
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 126919190
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methylquinoline-6-carboxamide
CID 126918858
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methylisoquinoline-1-carboxamide
CID 126918796
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methyl-1,3-benzoxazol-2-amine
CID 126918884
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N-methyl-1H-benzimidazol-2-amine
CID 126918903
1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)-N-methyl-N-(pyridin-3-ylmethyl)azetidin-3-amine
CID 126918908
6-tert-butyl-N-methyl-N-[1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-yl]pyridazin-3-amine
CID 126919645
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-6-methoxy-N-methylquinolin-4-amine
CID 126918901
N-benzyl-N-methyl-1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-amine
CID 126919881
N-[1-(6-tert-butylpyridazin-3-yl)azetidin-3-yl]-N-methyl-6,7-dihydro-5H-cyclopenta[c]pyridazin-3-amine
CID 126918184
N-methyl-N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-1-(5,6,7,8-tetrahydrocinnolin-3-yl)azetidin-3-amine
CID 126919626
N-[(2-cyclopropylpyrimidin-4-yl)methyl]-1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)-N-methylazetidin-3-amine
CID 126919008

Frequently Asked Questions

What is the IUPAC name of N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine (CID 126919209) is N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine is Cc1nc(N(C)C2CN(c3cc4c(nn3)CCC4)C2)c2cccnc2n1.
What is the InChIKey of N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine?
The InChIKey is VUNPMJLBTWBEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N7/c1-12-21-18-15(6-4-8-20-18)19(22-12)25(2)14-10-26(11-14)17-9-13-5-3-7-16(13)23-24-17/h4,6,8-9,14H,3,5,7,10-11H2,1-2H3.
What are the key properties of N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine?
N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine has a molecular weight of 347.43 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)azetidin-3-yl]-N,2-dimethylpyrido[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 126919209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).