2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine

C12H20N2O — CID 81403374

IUPAC2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine
SMILESC[C@H](NC1CCCC1CN)c1ccco1
InChIInChI=1S/C12H20N2O/c1-9(12-6-3-7-15-12)14-11-5-2-4-10(11)8-13/h3,6-7,9-11,14H,2,4-5,8,13H2,1H3/t9-,10?,11?/m0/s1
InChIKeyNTUXZPQNSBPZOO-WHXUTIOJSA-N
MW208.31 g/mol
LogP2.06
Rot. Bonds4

About 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine

2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine (PubChem CID 81403374) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine
PubChem CID81403374
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC Name2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine
SMILESC[C@H](NC1CCCC1CN)c1ccco1
InChIInChI=1S/C12H20N2O/c1-9(12-6-3-7-15-12)14-11-5-2-4-10(11)8-13/h3,6-7,9-11,14H,2,4-5,8,13H2,1H3/t9-,10?,11?/m0/s1
InChIKeyNTUXZPQNSBPZOO-WHXUTIOJSA-N
XLogP2.06
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-[(1R)-1-(furan-2-yl)ethyl]cyclohexan-1-amine
CID 81403207
trans-(1S,2S)-2-[[(1S)-1-(furan-2-yl)ethyl]amino]cyclopentan-1-ol
CID 102733843
N-[1-(furan-2-yl)ethyl]-2-methylsulfanylcyclopentan-1-amine
CID 103786666
2-[[(1S)-1-(furan-2-yl)ethyl]amino]cycloheptan-1-ol
CID 81399364
N-[(1R)-1-(furan-2-yl)ethyl]-2-methylsulfonylcyclopentan-1-amine
CID 81403412
2-(aminomethyl)-N-[(1R)-1-(3-fluorophenyl)ethyl]cyclopentan-1-amine
CID 81364867
N-[(1S)-1-(furan-2-yl)ethyl]-2-methyloxolan-3-amine
CID 82718277
2-(aminomethyl)-N-[(1S)-1-(4-bromophenyl)ethyl]cyclohexan-1-amine
CID 81354238
(3R,4R)-4-[1-(furan-2-yl)ethylamino]pyrrolidin-3-ol
CID 131175689
N-[(1R)-1-(furan-2-yl)ethyl]oxetan-3-amine
CID 81403066
N-[1-(furan-2-yl)ethyl]spiro[4.5]decan-8-amine
CID 114817252
N-[(1S)-1-(furan-2-yl)ethyl]oxan-3-amine
CID 81402561

Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine?
The IUPAC name of 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine (CID 81403374) is 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine.
What is the SMILES notation for 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine?
The canonical SMILES for 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine is C[C@H](NC1CCCC1CN)c1ccco1.
What is the InChIKey of 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine?
The InChIKey is NTUXZPQNSBPZOO-WHXUTIOJSA-N. The full InChI is InChI=1S/C12H20N2O/c1-9(12-6-3-7-15-12)14-11-5-2-4-10(11)8-13/h3,6-7,9-11,14H,2,4-5,8,13H2,1H3/t9-,10?,11?/m0/s1.
What are the key properties of 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine?
2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine has a molecular weight of 208.31 g/mol, XLogP of 2.06, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminomethyl)-N-[(1S)-1-(furan-2-yl)ethyl]cyclopentan-1-amine is sourced from PubChem (CID 81403374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).