2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide

C12H18N2O2 — CID 64816984

IUPAC2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCc1ccco1
InChIInChI=1S/C12H18N2O2/c13-11-6-2-1-5-10(11)12(15)14-8-9-4-3-7-16-9/h3-4,7,10-11H,1-2,5-6,8,13H2,(H,14,15)
InChIKeyOANNMFQMHBCHPD-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.41
Rot. Bonds3

About 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide

2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide (PubChem CID 64816984) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide
PubChem CID64816984
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCc1ccco1
InChIInChI=1S/C12H18N2O2/c13-11-6-2-1-5-10(11)12(15)14-8-9-4-3-7-16-9/h3-4,7,10-11H,1-2,5-6,8,13H2,(H,14,15)
InChIKeyOANNMFQMHBCHPD-UHFFFAOYSA-N
XLogP1.41
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(furan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 63789935
trans-(1S,3S)-1-N,3-N-bis(furan-2-ylmethyl)cyclohexane-1,3-dicarboxamide
CID 94798892
trans-(1R,3R)-3-(furan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 124510443
cis-(1S,2R)-2-N-(furan-2-ylmethyl)cyclohexane-1,2-diamine
CID 124676095
1-(cyclopentylmethyl)-3-(furan-2-ylmethyl)urea
CID 47172133
1-N,2-N-bis(furan-2-ylmethyl)-3-methylidenecyclopropane-1,2-dicarboxamide
CID 5237325
4-N-cyclopropyl-1-N-(furan-2-ylmethyl)cyclohexane-1,4-dicarboxamide
CID 109144668
N-(furan-2-ylmethyl)tricyclo[3.2.1.02,4]octane-3-carboxamide
CID 557216
N-(furan-2-ylmethyl)-2-(pyrrolidine-1-carbonyl)cyclopropane-1-carboxamide
CID 109131808
2-[2-(furan-2-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 54867947
(1R,2R,3S,4R)-3-(furan-2-ylmethylcarbamoyl)-7-oxabicyclo[2.2.1]heptane-2-carboxylic acid
CID 124724780
2-(cyclohexylamino)-N-(furan-2-ylmethyl)acetamide
CID 54816411

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide (CID 64816984) is 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide is NC1CCCCC1C(=O)NCc1ccco1.
What is the InChIKey of 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide?
The InChIKey is OANNMFQMHBCHPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c13-11-6-2-1-5-10(11)12(15)14-8-9-4-3-7-16-9/h3-4,7,10-11H,1-2,5-6,8,13H2,(H,14,15).
What are the key properties of 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide?
2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide has a molecular weight of 222.29 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 64816984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).