N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine

C14H16N2 — CID 116997781

IUPACN-[(3-methylquinolin-6-yl)methyl]cyclopropanamine
SMILESCc1cnc2ccc(CNC3CC3)cc2c1
InChIInChI=1S/C14H16N2/c1-10-6-12-7-11(9-15-13-3-4-13)2-5-14(12)16-8-10/h2,5-8,13,15H,3-4,9H2,1H3
InChIKeyXPSKKBOROZICCF-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.80
Rot. Bonds3

About N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine

N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine (PubChem CID 116997781) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(3-methylquinolin-6-yl)methyl]cyclopropanamine
PubChem CID116997781
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC NameN-[(3-methylquinolin-6-yl)methyl]cyclopropanamine
SMILESCc1cnc2ccc(CNC3CC3)cc2c1
InChIInChI=1S/C14H16N2/c1-10-6-12-7-11(9-15-13-3-4-13)2-5-14(12)16-8-10/h2,5-8,13,15H,3-4,9H2,1H3
InChIKeyXPSKKBOROZICCF-UHFFFAOYSA-N
XLogP2.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-6-(piperidin-4-ylmethyl)quinoline
CID 116997415
4-N-[(2-methylquinolin-6-yl)methyl]cyclohexane-1,4-diamine
CID 105378440
6-(2-chloroethyl)-3-methylquinoline
CID 116997430
N-[(6-methyl-3-pyridinyl)methyl]cyclopropanamine
CID 43163855
N-ethyl-2-(3-methylquinolin-6-yl)ethanamine
CID 116997407
3-methyl-6-(piperidin-3-ylmethyl)quinoline
CID 116997414
N-(quinolin-6-ylmethyl)thian-4-amine
CID 115615624
N-[(3-methylphenyl)methyl]cyclopropanamine
CID 16776498
N-(quinolin-7-ylmethyl)cyclopropanamine
CID 78921001
N-methyl-3-[(3-methylquinolin-6-yl)methyl]aniline
CID 116997422
[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol
CID 116997477
[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanamine
CID 116997478

Frequently Asked Questions

What is the IUPAC name of N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine?
The IUPAC name of N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine (CID 116997781) is N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine?
The canonical SMILES for N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine is Cc1cnc2ccc(CNC3CC3)cc2c1.
What is the InChIKey of N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine?
The InChIKey is XPSKKBOROZICCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-10-6-12-7-11(9-15-13-3-4-13)2-5-14(12)16-8-10/h2,5-8,13,15H,3-4,9H2,1H3.
What are the key properties of N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine?
N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine has a molecular weight of 212.30 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine is sourced from PubChem (CID 116997781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).