N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine

C16H20N4 — CID 62746699

IUPACN-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine
SMILESCc1cccnc1-c1nc(C)c(CNC2CC2)c(C)n1
InChIInChI=1S/C16H20N4/c1-10-5-4-8-17-15(10)16-19-11(2)14(12(3)20-16)9-18-13-6-7-13/h4-5,8,13,18H,6-7,9H2,1-3H3
InChIKeyILFZYSSNRCFHMO-UHFFFAOYSA-N
MW268.36 g/mol
LogP2.72
Rot. Bonds4

About N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine

N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine (PubChem CID 62746699) has the molecular formula C16H20N4 and a molecular weight of 268.36 g/mol. Its IUPAC name is N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine
PubChem CID62746699
Molecular FormulaC16H20N4
Molecular Weight268.36 g/mol
Exact Mass268.17
IUPAC NameN-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine
SMILESCc1cccnc1-c1nc(C)c(CNC2CC2)c(C)n1
InChIInChI=1S/C16H20N4/c1-10-5-4-8-17-15(10)16-19-11(2)14(12(3)20-16)9-18-13-6-7-13/h4-5,8,13,18H,6-7,9H2,1-3H3
InChIKeyILFZYSSNRCFHMO-UHFFFAOYSA-N
XLogP2.72
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
CID 62746207
N-[(4,6-dimethyl-2-pyrimidin-4-ylpyrimidin-5-yl)methyl]cyclopropanamine
CID 63989194
N-[2-[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]ethyl]propan-2-amine
CID 62744066
N-[(3-methyl-2-pyridinyl)methyl]cyclobutanamine
CID 63305574
4-N-[(3-methyl-2-pyridinyl)methyl]cyclohexane-1,4-diamine
CID 79740955
N-[[2-(3-bromo-4-fluorophenyl)-4,6-dimethylpyrimidin-5-yl]methyl]cyclopropanamine
CID 82790078
N-[[2-(6-methoxypyridazin-3-yl)-4,6-dimethylpyrimidin-5-yl]methyl]cyclopropanamine
CID 103375222
N-[(4-methyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
CID 114206497
N-[2-(4,6-dimethyl-2-pyridin-3-ylpyrimidin-5-yl)ethyl]cyclopropanamine
CID 62744074
N-[[4,6-dimethyl-2-(thiophen-2-ylmethyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 62746521
N,6-dimethyl-2-(3-methyl-2-pyridinyl)-5-propan-2-ylpyrimidin-4-amine
CID 62915108
N-[(3,5-dimethyl-1-pyrimidin-2-ylpyrazol-4-yl)methyl]cyclopropanamine
CID 61272914

Frequently Asked Questions

What is the IUPAC name of N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine (CID 62746699) is N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine is Cc1cccnc1-c1nc(C)c(CNC2CC2)c(C)n1.
What is the InChIKey of N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine?
The InChIKey is ILFZYSSNRCFHMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4/c1-10-5-4-8-17-15(10)16-19-11(2)14(12(3)20-16)9-18-13-6-7-13/h4-5,8,13,18H,6-7,9H2,1-3H3.
What are the key properties of N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine?
N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine has a molecular weight of 268.36 g/mol, XLogP of 2.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62746699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).