1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine

C15H17N3 — CID 173207711

IUPAC1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine
SMILESc1cnc(-c2ccccc2CNCC2CC2)nc1
InChIInChI=1S/C15H17N3/c1-2-5-14(15-17-8-3-9-18-15)13(4-1)11-16-10-12-6-7-12/h1-5,8-9,12,16H,6-7,10-11H2
InChIKeyDMYNSAOWOKJOKM-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.64
Rot. Bonds5

About 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine

1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine (PubChem CID 173207711) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine
PubChem CID173207711
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC Name1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine
SMILESc1cnc(-c2ccccc2CNCC2CC2)nc1
InChIInChI=1S/C15H17N3/c1-2-5-14(15-17-8-3-9-18-15)13(4-1)11-16-10-12-6-7-12/h1-5,8-9,12,16H,6-7,10-11H2
InChIKeyDMYNSAOWOKJOKM-UHFFFAOYSA-N
XLogP2.64
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-cyclopropyl-N-[(2-pyridin-2-ylphenyl)methyl]methanamine
CID 173207680
N-[(2-phenylphenyl)methyl]-1-piperidin-4-ylmethanamine
CID 155181758
2-[(cyclopentylmethylamino)methyl]phenol
CID 43370918
2-[(cyclopropylmethylamino)methyl]-N-methylaniline
CID 106703472
1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
CID 43298300
1-cyclobutyl-N-(quinolin-4-ylmethyl)methanamine
CID 63850221
1-cyclopropyl-N-[[2-(2-phenoxyethoxy)phenyl]methyl]methanamine
CID 54805017
2-[[(4-tert-butylcyclohexyl)methylamino]methyl]phenol
CID 114331599
2-[(piperidin-4-ylmethylamino)methyl]phenol
CID 114331586
1-cyclopropyl-N-[(2,3-difluorophenyl)methyl]methanamine
CID 43658793
N-[(2-bromophenyl)methyl]-1-(4-ethylcyclohexyl)methanamine
CID 63451692
1-(4-tert-butylcyclohexyl)-N-[(3-ethyl-2-pyridinyl)methyl]methanamine
CID 104575269

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine?
The IUPAC name of 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine (CID 173207711) is 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine.
What is the SMILES notation for 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine?
The canonical SMILES for 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine is c1cnc(-c2ccccc2CNCC2CC2)nc1.
What is the InChIKey of 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine?
The InChIKey is DMYNSAOWOKJOKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-2-5-14(15-17-8-3-9-18-15)13(4-1)11-16-10-12-6-7-12/h1-5,8-9,12,16H,6-7,10-11H2.
What are the key properties of 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine?
1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine has a molecular weight of 239.32 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(2-pyrimidin-2-ylphenyl)methyl]methanamine is sourced from PubChem (CID 173207711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).