N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide

C14H27N3O — CID 79155705

IUPACN-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide
SMILESCN(C(=O)N1CCCCC1)C1(CN)CCCCC1
InChIInChI=1S/C14H27N3O/c1-16(13(18)17-10-6-3-7-11-17)14(12-15)8-4-2-5-9-14/h2-12,15H2,1H3
InChIKeyNMLOBDRYFZRBNZ-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.19
Rot. Bonds2

About N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide

N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide (PubChem CID 79155705) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide
PubChem CID79155705
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide
SMILESCN(C(=O)N1CCCCC1)C1(CN)CCCCC1
InChIInChI=1S/C14H27N3O/c1-16(13(18)17-10-6-3-7-11-17)14(12-15)8-4-2-5-9-14/h2-12,15H2,1H3
InChIKeyNMLOBDRYFZRBNZ-UHFFFAOYSA-N
XLogP2.19
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(aminomethyl)cyclohexyl]-N-propylazepane-1-carboxamide
CID 79157486
2-[[1-(aminomethyl)cyclohexyl]-methylamino]-1-piperidin-1-ylethanone
CID 62004874
N-[1-(aminomethyl)-4-methylcyclohexyl]-N,4-dimethylpiperidine-1-carboxamide
CID 79160492
2-[[1-(aminomethyl)cyclohexyl]-ethylamino]-1-(azepan-1-yl)ethanone
CID 62006174
2-[[1-(aminomethyl)cyclopentyl]-propylamino]-1-piperidin-1-ylethanone
CID 62010554
N-(3-aminopropyl)-N-methylpiperidine-1-carboxamide
CID 79155525
N-(1-aminopropan-2-yl)-N-methylazepane-1-carboxamide
CID 79152627
N-[1-(aminomethyl)-4-ethylcyclohexyl]-N-ethylpyrrolidine-1-carboxamide
CID 79161718
N-(3-aminopropyl)-N-methylpyrrolidine-1-carboxamide
CID 79160813
[1-(aminomethyl)cyclopentyl]-(azepan-1-yl)methanone;hydrochloride
CID 119669538
N-(5-aminopentyl)-N-methylpiperidine-1-carboxamide
CID 107206810
N-(3-amino-2-methylpropyl)-N-methylazepane-1-carboxamide
CID 79152799

Frequently Asked Questions

What is the IUPAC name of N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide?
The IUPAC name of N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide (CID 79155705) is N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide?
The canonical SMILES for N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide is CN(C(=O)N1CCCCC1)C1(CN)CCCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide?
The InChIKey is NMLOBDRYFZRBNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-16(13(18)17-10-6-3-7-11-17)14(12-15)8-4-2-5-9-14/h2-12,15H2,1H3.
What are the key properties of N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide?
N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclohexyl]-N-methylpiperidine-1-carboxamide is sourced from PubChem (CID 79155705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).