[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine

C14H16N2 — CID 116997369

IUPAC[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine
SMILESNCC1(Cc2ccc3ncccc3c2)CC1
InChIInChI=1S/C14H16N2/c15-10-14(5-6-14)9-11-3-4-13-12(8-11)2-1-7-16-13/h1-4,7-8H,5-6,9-10,15H2
InChIKeyLTEKEKRXLPJTGD-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.52
Rot. Bonds3

About [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine

[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine (PubChem CID 116997369) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine
PubChem CID116997369
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine
SMILESNCC1(Cc2ccc3ncccc3c2)CC1
InChIInChI=1S/C14H16N2/c15-10-14(5-6-14)9-11-3-4-13-12(8-11)2-1-7-16-13/h1-4,7-8H,5-6,9-10,15H2
InChIKeyLTEKEKRXLPJTGD-UHFFFAOYSA-N
XLogP2.52
TPSA38.91 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 ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine?
The IUPAC name of [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine (CID 116997369) is [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine?
The canonical SMILES for [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine is NCC1(Cc2ccc3ncccc3c2)CC1.
What is the InChIKey of [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine?
The InChIKey is LTEKEKRXLPJTGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c15-10-14(5-6-14)9-11-3-4-13-12(8-11)2-1-7-16-13/h1-4,7-8H,5-6,9-10,15H2.
What are the key properties of [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine?
[1-(quinolin-6-ylmethyl)cyclopropyl]methanamine has a molecular weight of 212.30 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(quinolin-6-ylmethyl)cyclopropyl]methanamine is sourced from PubChem (CID 116997369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).