N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride

C17H34ClN3O — CID 119933013

IUPACN-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
SMILESCCCN(CC(=O)NC1CCC(C)CC1)C1CCNCC1.Cl
InChIInChI=1S/C17H33N3O.ClH/c1-3-12-20(16-8-10-18-11-9-16)13-17(21)19-15-6-4-14(2)5-7-15;/h14-16,18H,3-13H2,1-2H3,(H,19,21);1H
InChIKeyIVXIFEJZZZLXCT-UHFFFAOYSA-N
MW331.93 g/mol
LogP2.57
Rot. Bonds6

About N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride

N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride (PubChem CID 119933013) has the molecular formula C17H34ClN3O and a molecular weight of 331.93 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
PubChem CID119933013
Molecular FormulaC17H34ClN3O
Molecular Weight331.93 g/mol
Exact Mass331.24
IUPAC NameN-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
SMILESCCCN(CC(=O)NC1CCC(C)CC1)C1CCNCC1.Cl
InChIInChI=1S/C17H33N3O.ClH/c1-3-12-20(16-8-10-18-11-9-16)13-17(21)19-15-6-4-14(2)5-7-15;/h14-16,18H,3-13H2,1-2H3,(H,19,21);1H
InChIKeyIVXIFEJZZZLXCT-UHFFFAOYSA-N
XLogP2.57
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.93
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylcyclohexyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921661
N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119933007
2-[azetidin-3-yl(propyl)amino]-N-cyclopropylacetamide
CID 66216105
N-ethyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60807335
N-(cyclopropylmethyl)-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60806815
1-[piperidin-4-yl(propyl)amino]pentan-2-one
CID 62044449
2-[piperidin-4-yl(propyl)amino]-N,N-dipropylacetamide
CID 60805133
N-(2-methylpropylcarbamoyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119932861
3,3-dimethyl-1-[piperidin-4-yl(propyl)amino]butan-2-one
CID 62030880
1-(3,5-dimethylpiperidin-1-yl)-2-[piperidin-4-yl(propyl)amino]ethanone
CID 60806824
N-propan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921653
N-(2,3-dimethylcyclohexyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide
CID 63304066

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
The IUPAC name of N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride (CID 119933013) is N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
The canonical SMILES for N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride is CCCN(CC(=O)NC1CCC(C)CC1)C1CCNCC1.Cl.
What is the InChIKey of N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
The InChIKey is IVXIFEJZZZLXCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O.ClH/c1-3-12-20(16-8-10-18-11-9-16)13-17(21)19-15-6-4-14(2)5-7-15;/h14-16,18H,3-13H2,1-2H3,(H,19,21);1H.
What are the key properties of N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride has a molecular weight of 331.93 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119933013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).