1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride

C15H30ClN3O2 — CID 119665001

IUPAC1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)C1(NC(C)=O)CCCCC1.Cl
InChIInChI=1S/C15H29N3O2.ClH/c1-3-4-8-13(11-16)17-14(20)15(18-12(2)19)9-6-5-7-10-15;/h13H,3-11,16H2,1-2H3,(H,17,20)(H,18,19);1H
InChIKeyJCRMPHORVDKSHV-UHFFFAOYSA-N
MW319.88 g/mol
LogP1.88
Rot. Bonds7

About 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride

1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride (PubChem CID 119665001) has the molecular formula C15H30ClN3O2 and a molecular weight of 319.88 g/mol. Its IUPAC name is 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride
PubChem CID119665001
Molecular FormulaC15H30ClN3O2
Molecular Weight319.88 g/mol
Exact Mass319.20
IUPAC Name1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride
SMILESCCCCC(CN)NC(=O)C1(NC(C)=O)CCCCC1.Cl
InChIInChI=1S/C15H29N3O2.ClH/c1-3-4-8-13(11-16)17-14(20)15(18-12(2)19)9-6-5-7-10-15;/h13H,3-11,16H2,1-2H3,(H,17,20)(H,18,19);1H
InChIKeyJCRMPHORVDKSHV-UHFFFAOYSA-N
XLogP1.88
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.88
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide
CID 119665002
1-acetamido-N-butan-2-ylcyclohexane-1-carboxamide
CID 47345116
N-(1-aminohexan-2-yl)-1-phenylcyclopentane-1-carboxamide;hydrochloride
CID 119667911
N-(1-aminohexan-2-yl)cyclohexanecarboxamide
CID 80697500
benzyl N-[1-(1-hydroxyhexan-2-ylcarbamoyl)cyclohexyl]carbamate
CID 74341660
1-acetamido-N-(2-methylpropyl)cyclohexane-1-carboxamide
CID 47345134
N-(1-aminohexan-2-yl)-1-(3-fluorophenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119664783
N-(1-aminohexan-2-yl)-1-phenylcyclopropane-1-carboxamide
CID 80698357
1-carbamothioyl-N-octan-4-ylcycloheptane-1-carboxamide
CID 106023670
N-(1-aminohexan-2-yl)-1-benzylcyclopropane-1-carboxamide
CID 119667821
N-(1-aminohexan-2-yl)-1-(3-methoxyphenyl)cyclopentane-1-carboxamide
CID 119666253
3-(1-aminohexan-2-yl)-1,1-dimethylurea
CID 80697976

Frequently Asked Questions

What is the IUPAC name of 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride?
The IUPAC name of 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride (CID 119665001) is 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride is CCCCC(CN)NC(=O)C1(NC(C)=O)CCCCC1.Cl.
What is the InChIKey of 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride?
The InChIKey is JCRMPHORVDKSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2.ClH/c1-3-4-8-13(11-16)17-14(20)15(18-12(2)19)9-6-5-7-10-15;/h13H,3-11,16H2,1-2H3,(H,17,20)(H,18,19);1H.
What are the key properties of 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride?
1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride has a molecular weight of 319.88 g/mol, XLogP of 1.88, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetamido-N-(1-aminohexan-2-yl)cyclohexane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119665001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).