[2-(furan-2-yl)pyrrolidin-3-yl]methanamine

C9H14N2O — CID 82414177

IUPAC[2-(furan-2-yl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCNC1c1ccco1
InChIInChI=1S/C9H14N2O/c10-6-7-3-4-11-9(7)8-2-1-5-12-8/h1-2,5,7,9,11H,3-4,6,10H2
InChIKeyKWVMEWZGWDMQSO-UHFFFAOYSA-N
MW166.22 g/mol
LogP0.89
Rot. Bonds2

About [2-(furan-2-yl)pyrrolidin-3-yl]methanamine

[2-(furan-2-yl)pyrrolidin-3-yl]methanamine (PubChem CID 82414177) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is [2-(furan-2-yl)pyrrolidin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(furan-2-yl)pyrrolidin-3-yl]methanamine
PubChem CID82414177
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name[2-(furan-2-yl)pyrrolidin-3-yl]methanamine
SMILESNCC1CCNC1c1ccco1
InChIInChI=1S/C9H14N2O/c10-6-7-3-4-11-9(7)8-2-1-5-12-8/h1-2,5,7,9,11H,3-4,6,10H2
InChIKeyKWVMEWZGWDMQSO-UHFFFAOYSA-N
XLogP0.89
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(furan-2-yl)piperidin-3-amine
CID 82125093
[2-(1,3-oxazol-5-yl)pyrrolidin-3-yl]methanamine
CID 82413741
[2-(furan-2-yl)cycloheptyl]methanamine
CID 81010401
(2S,4R)-4-(furan-2-yl)-2-prop-2-enylpiperidine
CID 101201496
4-(furan-2-yl)piperidine-2-carboxamide
CID 65347712
[(3S,4S)-4-(furan-2-yl)-1-methylpyrrolidin-3-yl]methanamine
CID 96744208
3-amino-4-(furan-2-yl)azetidin-2-one
CID 82417177
[2-(2,4-dimethyl-1H-indol-3-yl)pyrrolidin-3-yl]methanamine
CID 82386121
[2-(5-methyl-1,2-oxazol-3-yl)pyrrolidin-3-yl]methanamine
CID 82408303
(2R)-2-[[(2S,3S)-2-(furan-2-yl)azepan-3-yl]amino]-2-phenylethanol
CID 15474643
2-(thian-4-yl)furan
CID 68570880
methyl 4-(furan-2-yl)piperidine-2-carboxylate
CID 117258292

Frequently Asked Questions

What is the IUPAC name of [2-(furan-2-yl)pyrrolidin-3-yl]methanamine?
The IUPAC name of [2-(furan-2-yl)pyrrolidin-3-yl]methanamine (CID 82414177) is [2-(furan-2-yl)pyrrolidin-3-yl]methanamine.
What is the SMILES notation for [2-(furan-2-yl)pyrrolidin-3-yl]methanamine?
The canonical SMILES for [2-(furan-2-yl)pyrrolidin-3-yl]methanamine is NCC1CCNC1c1ccco1.
What is the InChIKey of [2-(furan-2-yl)pyrrolidin-3-yl]methanamine?
The InChIKey is KWVMEWZGWDMQSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c10-6-7-3-4-11-9(7)8-2-1-5-12-8/h1-2,5,7,9,11H,3-4,6,10H2.
What are the key properties of [2-(furan-2-yl)pyrrolidin-3-yl]methanamine?
[2-(furan-2-yl)pyrrolidin-3-yl]methanamine has a molecular weight of 166.22 g/mol, XLogP of 0.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(furan-2-yl)pyrrolidin-3-yl]methanamine is sourced from PubChem (CID 82414177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).