2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide

C12H22N2O2 — CID 62825271

IUPAC2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCC1CCOC1
InChIInChI=1S/C12H22N2O2/c13-11-4-2-1-3-10(11)12(15)14-7-9-5-6-16-8-9/h9-11H,1-8,13H2,(H,14,15)
InChIKeyHGWZCAPLCRHGME-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.66
Rot. Bonds3

About 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide

2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide (PubChem CID 62825271) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide
PubChem CID62825271
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide
SMILESNC1CCCCC1C(=O)NCC1CCOC1
InChIInChI=1S/C12H22N2O2/c13-11-4-2-1-3-10(11)12(15)14-7-9-5-6-16-8-9/h9-11H,1-8,13H2,(H,14,15)
InChIKeyHGWZCAPLCRHGME-UHFFFAOYSA-N
XLogP0.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(oxolan-3-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid
CID 54933491
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133
2-(oxolan-3-ylmethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103978063
2-amino-N-(cyclohexylmethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119672519
2-amino-N-[(4-methylcyclohexyl)methyl]cyclohexane-1-carboxamide
CID 63247870
2-amino-N-[(1-methylpiperidin-4-yl)methyl]cyclohexane-1-carboxamide
CID 62776858
3-(oxolan-3-ylmethylcarbamoyl)cyclopentane-1-carboxylic acid
CID 103550051
2-methyl-N-(oxolan-3-ylmethyl)pyrrolidine-3-carboxamide
CID 79388592
4-amino-2,2,3-trimethyl-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide
CID 102628487
2-amino-N-(thiolan-3-ylmethyl)cyclopentane-1-carboxamide
CID 107295904
(2S)-N-(oxolan-3-ylmethyl)pyrrolidine-2-carboxamide
CID 61179027
N-[(2-aminocyclopentyl)methyl]-3-methyloxane-4-carboxamide
CID 114241768

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide (CID 62825271) is 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide is NC1CCCCC1C(=O)NCC1CCOC1.
What is the InChIKey of 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide?
The InChIKey is HGWZCAPLCRHGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c13-11-4-2-1-3-10(11)12(15)14-7-9-5-6-16-8-9/h9-11H,1-8,13H2,(H,14,15).
What are the key properties of 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide?
2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 62825271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).