N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide

C14H26N2O — CID 107397929

IUPACN-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide
SMILESCCN(CC1CCC1)C(=O)N1CCCCCC1
InChIInChI=1S/C14H26N2O/c1-2-15(12-13-8-7-9-13)14(17)16-10-5-3-4-6-11-16/h13H,2-12H2,1H3
InChIKeyFDQNRGGHYONPGP-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.10
Rot. Bonds3

About N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide

N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide (PubChem CID 107397929) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide
PubChem CID107397929
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC NameN-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide
SMILESCCN(CC1CCC1)C(=O)N1CCCCCC1
InChIInChI=1S/C14H26N2O/c1-2-15(12-13-8-7-9-13)14(17)16-10-5-3-4-6-11-16/h13H,2-12H2,1H3
InChIKeyFDQNRGGHYONPGP-UHFFFAOYSA-N
XLogP3.10
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(cyclobutylmethyl)-N-ethylpyrrolidine-1-carboxamide
CID 107397947
N-(cyclopropylmethyl)-N-propylpyrrolidine-1-carboxamide
CID 115578768
2-[cyclopropylmethyl(piperidine-1-carbonyl)amino]acetic acid
CID 43655845
N-(cyclobutylmethyl)-N-methylpyrrolidine-1-carboxamide
CID 115621970
N-ethyl-N-(oxolan-2-ylmethyl)piperidine-1-carboxamide
CID 115590777
2-[1-[cyclopropylmethyl(ethyl)carbamoyl]piperidin-4-yl]acetic acid
CID 79606749
1-[cyclobutylmethyl(ethyl)carbamoyl]-3-ethylpyrrolidine-3-carboxylic acid
CID 107400193
1-[cyclobutylmethyl(ethyl)carbamoyl]-3-propan-2-ylpyrrolidine-3-carboxylic acid
CID 107400103
N-(2-amino-2-oxoethyl)-N-ethylazepane-1-carboxamide
CID 103101659
1-(cyclopropanecarbonyl)-N-(cyclopropylmethyl)-N-ethylpiperidine-3-carboxamide
CID 71931628
4-(3-cyclohexylpropanoyl)-N,N-diethylpiperazine-1-carboxamide
CID 108569569
2-[ethyl(pyrrolidine-1-carbonyl)amino]acetic acid
CID 61187489

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide?
The IUPAC name of N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide (CID 107397929) is N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide.
What is the SMILES notation for N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide?
The canonical SMILES for N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide is CCN(CC1CCC1)C(=O)N1CCCCCC1.
What is the InChIKey of N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide?
The InChIKey is FDQNRGGHYONPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-15(12-13-8-7-9-13)14(17)16-10-5-3-4-6-11-16/h13H,2-12H2,1H3.
What are the key properties of N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide?
N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide has a molecular weight of 238.37 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-ethylazepane-1-carboxamide is sourced from PubChem (CID 107397929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).