[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine

C15H19N3 — CID 62062726

IUPAC[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCN(Cc2ccc3ncccc3c2)C1
InChIInChI=1S/C15H19N3/c16-9-13-5-7-18(11-13)10-12-3-4-15-14(8-12)2-1-6-17-15/h1-4,6,8,13H,5,7,9-11,16H2
InChIKeyUJAUZMFNMPEZBQ-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.02
Rot. Bonds3

About [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine

[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine (PubChem CID 62062726) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine
PubChem CID62062726
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCN(Cc2ccc3ncccc3c2)C1
InChIInChI=1S/C15H19N3/c16-9-13-5-7-18(11-13)10-12-3-4-15-14(8-12)2-1-6-17-15/h1-4,6,8,13H,5,7,9-11,16H2
InChIKeyUJAUZMFNMPEZBQ-UHFFFAOYSA-N
XLogP2.02
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-(quinolin-6-ylmethyl)pyrrolidin-3-ol
CID 79031483
6-[(4-chloro-3-methylpiperidin-1-yl)methyl]quinoline
CID 114682261
6-[[(3S)-3-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-1-yl]methyl]quinoline
CID 95829818
3-[[1-(quinolin-6-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113146
3,3-dimethyl-1-(quinolin-6-ylmethyl)piperidin-4-amine
CID 120781427
6-[[(3S)-3-methylpiperazin-1-yl]methyl]quinoline
CID 103885682
[4-methyl-1-(quinolin-6-ylmethyl)piperazin-2-yl]methanamine
CID 80504294
3-ethyl-N-methyl-1-(quinolin-6-ylmethyl)piperidin-4-amine
CID 114507998
[1-(quinolin-6-ylmethyl)piperidin-2-yl]methanamine
CID 43209671
4-methyl-1-(quinolin-6-ylmethyl)pyrrolidin-3-amine;hydrochloride
CID 120908917
6-[[4-(2-chloroethoxy)piperidin-1-yl]methyl]quinoline
CID 82684729
6-[[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]methyl]quinoline
CID 124568885

Frequently Asked Questions

What is the IUPAC name of [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine (CID 62062726) is [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine is NCC1CCN(Cc2ccc3ncccc3c2)C1.
What is the InChIKey of [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine?
The InChIKey is UJAUZMFNMPEZBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c16-9-13-5-7-18(11-13)10-12-3-4-15-14(8-12)2-1-6-17-15/h1-4,6,8,13H,5,7,9-11,16H2.
What are the key properties of [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine?
[1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(quinolin-6-ylmethyl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 62062726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).