N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine

C17H26N2 — CID 115375676

IUPACN-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine
SMILESCc1cncc(C2CCCCCC2CNC2CC2)c1
InChIInChI=1S/C17H26N2/c1-13-9-15(11-18-10-13)17-6-4-2-3-5-14(17)12-19-16-7-8-16/h9-11,14,16-17,19H,2-8,12H2,1H3
InChIKeyBKCBPHWSGIYWQU-UHFFFAOYSA-N
MW258.41 g/mol
LogP3.81
Rot. Bonds4

About N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine

N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine (PubChem CID 115375676) has the molecular formula C17H26N2 and a molecular weight of 258.41 g/mol. Its IUPAC name is N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine
PubChem CID115375676
Molecular FormulaC17H26N2
Molecular Weight258.41 g/mol
Exact Mass258.21
IUPAC NameN-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine
SMILESCc1cncc(C2CCCCCC2CNC2CC2)c1
InChIInChI=1S/C17H26N2/c1-13-9-15(11-18-10-13)17-6-4-2-3-5-14(17)12-19-16-7-8-16/h9-11,14,16-17,19H,2-8,12H2,1H3
InChIKeyBKCBPHWSGIYWQU-UHFFFAOYSA-N
XLogP3.81
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine 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

2-methyl-N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]propan-1-amine
CID 115375678
N-[[2-(5-methyl-3-pyridinyl)cyclohexyl]methyl]propan-1-amine
CID 115375664
N-[[2-(3-methylphenyl)cycloheptyl]methyl]cyclopropanamine
CID 81025221
N-methyl-2-(5-methyl-3-pyridinyl)cycloheptan-1-amine
CID 115375197
N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine
CID 81034690
N-ethyl-2-(5-methyl-3-pyridinyl)cyclopentan-1-amine
CID 115375195
N-[[2-(4-chlorophenyl)cycloheptyl]methyl]cyclopropanamine
CID 81025016
N-[[2-(3-fluoro-5-methylphenyl)cyclobutyl]methyl]cyclopropanamine
CID 81017647
N-[[2-(4-ethylphenyl)cyclohexyl]methyl]cyclopropanamine
CID 81024481
N-[[2-(2-methylphenyl)cycloheptyl]methyl]cyclopropanamine
CID 81026613
N-[[2-(2-methylpyrazol-3-yl)cycloheptyl]methyl]cyclopropanamine
CID 81025720
N-[[2-(4-cyclobutylphenyl)cyclopentyl]methyl]cyclopropanamine
CID 116507104

Frequently Asked Questions

What is the IUPAC name of N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine (CID 115375676) is N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine is Cc1cncc(C2CCCCCC2CNC2CC2)c1.
What is the InChIKey of N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine?
The InChIKey is BKCBPHWSGIYWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2/c1-13-9-15(11-18-10-13)17-6-4-2-3-5-14(17)12-19-16-7-8-16/h9-11,14,16-17,19H,2-8,12H2,1H3.
What are the key properties of N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine?
N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine has a molecular weight of 258.41 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine is sourced from PubChem (CID 115375676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).