2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile

C12H16N2O — CID 62741692

IUPAC2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile
SMILESN#CC1CCCC1NCCc1ccco1
InChIInChI=1S/C12H16N2O/c13-9-10-3-1-5-12(10)14-7-6-11-4-2-8-15-11/h2,4,8,10,12,14H,1,3,5-7H2
InChIKeyHQKAVHCXSBXQRW-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.10
Rot. Bonds4

About 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile

2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile (PubChem CID 62741692) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile
PubChem CID62741692
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile
SMILESN#CC1CCCC1NCCc1ccco1
InChIInChI=1S/C12H16N2O/c13-9-10-3-1-5-12(10)14-7-6-11-4-2-8-15-11/h2,4,8,10,12,14H,1,3,5-7H2
InChIKeyHQKAVHCXSBXQRW-UHFFFAOYSA-N
XLogP2.10
TPSA48.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)ethyl]-2-(trifluoromethyl)cyclohexan-1-amine
CID 64757656
N-[2-(furan-2-yl)ethyl]-2-methylthian-3-amine
CID 79957454
N-[2-(furan-2-yl)ethyl]-2-methylthiolan-3-amine
CID 102671359
N-[2-(furan-2-yl)ethyl]-4-methylcycloheptan-1-amine
CID 65080639
N-[2-(furan-2-yl)ethyl]thian-3-amine
CID 62873615
(3S,4S)-4-[2-(furan-2-yl)ethylamino]-1,1-dioxothiolan-3-ol
CID 42344850
2-(furan-2-ylmethoxy)cycloheptane-1-carbonitrile
CID 43292120
N-[2-(furan-2-yl)ethyl]-4-propylcycloheptan-1-amine
CID 65086403
3-N-[2-(furan-2-yl)ethyl]cyclopentane-1,3-diamine
CID 79462115
N-[2-(furan-2-yl)ethyl]-3-propan-2-yl-3-azabicyclo[3.3.1]nonan-9-amine
CID 61240419
N-[3-(furan-2-yl)propyl]cycloheptanamine
CID 60984430
N-[2-(furan-2-yl)ethyl]-4-phenylcyclohexan-1-amine
CID 43395503

Frequently Asked Questions

What is the IUPAC name of 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile?
The IUPAC name of 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile (CID 62741692) is 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile.
What is the SMILES notation for 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile?
The canonical SMILES for 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile is N#CC1CCCC1NCCc1ccco1.
What is the InChIKey of 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile?
The InChIKey is HQKAVHCXSBXQRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c13-9-10-3-1-5-12(10)14-7-6-11-4-2-8-15-11/h2,4,8,10,12,14H,1,3,5-7H2.
What are the key properties of 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile?
2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile has a molecular weight of 204.27 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(furan-2-yl)ethylamino]cyclopentane-1-carbonitrile is sourced from PubChem (CID 62741692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).