N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine

C15H18N4 — CID 62746207

IUPACN-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
SMILESCc1nc(-c2ccccn2)nc(C)c1CNC1CC1
InChIInChI=1S/C15H18N4/c1-10-13(9-17-12-6-7-12)11(2)19-15(18-10)14-5-3-4-8-16-14/h3-5,8,12,17H,6-7,9H2,1-2H3
InChIKeySAGXTUVYQLAKFH-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.41
Rot. Bonds4

About N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine

N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine (PubChem CID 62746207) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
PubChem CID62746207
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC NameN-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
SMILESCc1nc(-c2ccccn2)nc(C)c1CNC1CC1
InChIInChI=1S/C15H18N4/c1-10-13(9-17-12-6-7-12)11(2)19-15(18-10)14-5-3-4-8-16-14/h3-5,8,12,17H,6-7,9H2,1-2H3
InChIKeySAGXTUVYQLAKFH-UHFFFAOYSA-N
XLogP2.41
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-methyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine
CID 114206497
N-[(4,6-dimethyl-2-pyrimidin-4-ylpyrimidin-5-yl)methyl]cyclopropanamine
CID 63989194
1-(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)-N-methylmethanamine
CID 62745820
N-[[4,6-dimethyl-2-(3-methyl-2-pyridinyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 62746699
N-[2-(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)propyl]cyclopropanamine
CID 62756382
N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]ethanamine
CID 62744443
(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methanamine
CID 28916463
N-[(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)methyl]cyclopropanamine
CID 60837872
N-[[2-(6-methoxypyridazin-3-yl)-4,6-dimethylpyrimidin-5-yl]methyl]cyclopropanamine
CID 103375222
N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]cyclopropanamine
CID 43234356
ethane;N-(pyridin-2-ylmethyl)cyclopropanamine
CID 144801835
N-[(2-pyridin-2-yl-1H-imidazol-5-yl)methyl]cyclopropanamine
CID 63108999

Frequently Asked Questions

What is the IUPAC name of N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine (CID 62746207) is N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine is Cc1nc(-c2ccccn2)nc(C)c1CNC1CC1.
What is the InChIKey of N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine?
The InChIKey is SAGXTUVYQLAKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-10-13(9-17-12-6-7-12)11(2)19-15(18-10)14-5-3-4-8-16-14/h3-5,8,12,17H,6-7,9H2,1-2H3.
What are the key properties of N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine?
N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine has a molecular weight of 254.34 g/mol, XLogP of 2.41, 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-pyridin-2-ylpyrimidin-5-yl)methyl]cyclopropanamine is sourced from PubChem (CID 62746207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).