4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine

C14H19N5O — CID 82747168

IUPAC4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine
SMILESCCc1cccnc1CNc1ncnc(NC)c1OC
InChIInChI=1S/C14H19N5O/c1-4-10-6-5-7-16-11(10)8-17-14-12(20-3)13(15-2)18-9-19-14/h5-7,9H,4,8H2,1-3H3,(H2,15,17,18,19)
InChIKeyZXNAGCRPSMCWAC-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.10
Rot. Bonds6

About 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine

4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine (PubChem CID 82747168) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine
PubChem CID82747168
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC Name4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine
SMILESCCc1cccnc1CNc1ncnc(NC)c1OC
InChIInChI=1S/C14H19N5O/c1-4-10-6-5-7-16-11(10)8-17-14-12(20-3)13(15-2)18-9-19-14/h5-7,9H,4,8H2,1-3H3,(H2,15,17,18,19)
InChIKeyZXNAGCRPSMCWAC-UHFFFAOYSA-N
XLogP2.10
TPSA71.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine with MolForge

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Related Compounds

N-[(3,4-dimethoxy-2-pyridinyl)methyl]-1-(3-ethyl-2-pyridinyl)methanamine
CID 103172673
4-N-[(3-ethyl-2-pyridinyl)methyl]-6-propoxypyrimidine-4,5-diamine
CID 82733718
N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxypyrimidin-2-amine
CID 114600732
N-[(3-ethyl-2-pyridinyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine
CID 82740111
N-[(3-ethyl-2-pyridinyl)methyl]-7-methylthieno[3,2-d]pyrimidin-4-amine
CID 102686617
methyl 4-[(3-ethyl-2-pyridinyl)methylamino]pyrimidine-2-carboxylate
CID 82739095
N-[(3-ethyl-2-pyridinyl)methyl]-6-methoxy-3-nitropyridin-2-amine
CID 82736234
3-chloro-N-[(3-ethyl-2-pyridinyl)methyl]-5,6-dimethylpyrazin-2-amine
CID 82749017
5-methoxy-4-[(3-methyl-2-pyridinyl)methylamino]-1H-pyrimidin-6-one
CID 137016426
4-N-[(4-ethyl-1,2,4-triazol-3-yl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine
CID 106304492
N-[(3-ethyl-2-pyridinyl)methyl]-1,2,4-thiadiazol-5-amine
CID 82739102
6-chloro-N-[(3-ethyl-2-pyridinyl)methyl]-1H-pyrazolo[5,4-d]pyrimidin-4-amine
CID 82748227

Frequently Asked Questions

What is the IUPAC name of 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine?
The IUPAC name of 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine (CID 82747168) is 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine?
The canonical SMILES for 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine is CCc1cccnc1CNc1ncnc(NC)c1OC.
What is the InChIKey of 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine?
The InChIKey is ZXNAGCRPSMCWAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-4-10-6-5-7-16-11(10)8-17-14-12(20-3)13(15-2)18-9-19-14/h5-7,9H,4,8H2,1-3H3,(H2,15,17,18,19).
What are the key properties of 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine?
4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine has a molecular weight of 273.34 g/mol, XLogP of 2.10, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-[(3-ethyl-2-pyridinyl)methyl]-5-methoxy-6-N-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 82747168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).