N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine

C15H22N2 — CID 81034690

IUPACN-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine
SMILESCc1ccc(C2CCCC2CNC2CC2)cn1
InChIInChI=1S/C15H22N2/c1-11-5-6-13(9-16-11)15-4-2-3-12(15)10-17-14-7-8-14/h5-6,9,12,14-15,17H,2-4,7-8,10H2,1H3
InChIKeyNIQALNBEYKQWTF-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.03
Rot. Bonds4

About N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine

N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine (PubChem CID 81034690) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine
PubChem CID81034690
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine
SMILESCc1ccc(C2CCCC2CNC2CC2)cn1
InChIInChI=1S/C15H22N2/c1-11-5-6-13(9-16-11)15-4-2-3-12(15)10-17-14-7-8-14/h5-6,9,12,14-15,17H,2-4,7-8,10H2,1H3
InChIKeyNIQALNBEYKQWTF-UHFFFAOYSA-N
XLogP3.03
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[2-(6-methyl-3-pyridinyl)cycloheptyl]methyl]ethanamine
CID 81025284
N-[[2-(4-cyclobutylphenyl)cyclopentyl]methyl]cyclopropanamine
CID 116507104
N-[[2-(4-ethoxyphenyl)cyclopentyl]methyl]cyclopropanamine
CID 81034354
N-[(2-quinolin-7-ylcyclopentyl)methyl]cyclopropanamine
CID 81228417
N-[[2-(4-ethylphenyl)cyclohexyl]methyl]cyclopropanamine
CID 81024481
N-[[2-(5-methyl-3-pyridinyl)cycloheptyl]methyl]cyclopropanamine
CID 115375676
N-[[2-(4-chlorophenyl)cycloheptyl]methyl]cyclopropanamine
CID 81025016
2-(6-methyl-3-pyridinyl)cycloheptan-1-amine
CID 63156067
N-[[2-(3-methylphenyl)cycloheptyl]methyl]cyclopropanamine
CID 81025221
N-[(6-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 43163855
N-[[2-(3-ethoxyphenyl)cyclopentyl]methyl]cyclopropanamine
CID 81032583
N-[[2-(2,3-dimethylphenyl)cyclopentyl]methyl]cyclopropanamine
CID 81034688

Frequently Asked Questions

What is the IUPAC name of N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine (CID 81034690) is N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine is Cc1ccc(C2CCCC2CNC2CC2)cn1.
What is the InChIKey of N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine?
The InChIKey is NIQALNBEYKQWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-11-5-6-13(9-16-11)15-4-2-3-12(15)10-17-14-7-8-14/h5-6,9,12,14-15,17H,2-4,7-8,10H2,1H3.
What are the key properties of N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine?
N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine has a molecular weight of 230.35 g/mol, XLogP of 3.03, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine is sourced from PubChem (CID 81034690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).