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

C17H34ClN3O — CID 119933007

IUPACN-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
SMILESCCCN(CC(=O)NC1CCCCCC1)C1CCNCC1.Cl
InChIInChI=1S/C17H33N3O.ClH/c1-2-13-20(16-9-11-18-12-10-16)14-17(21)19-15-7-5-3-4-6-8-15;/h15-16,18H,2-14H2,1H3,(H,19,21);1H
InChIKeyKEGIPWBTQOUSCX-UHFFFAOYSA-N
MW331.93 g/mol
LogP2.71
Rot. Bonds6

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

N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride (PubChem CID 119933007) has the molecular formula C17H34ClN3O and a molecular weight of 331.93 g/mol. Its IUPAC name is N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride.

Molecular Properties

Compound NameN-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
PubChem CID119933007
Molecular FormulaC17H34ClN3O
Molecular Weight331.93 g/mol
Exact Mass331.24
IUPAC NameN-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
SMILESCCCN(CC(=O)NC1CCCCCC1)C1CCNCC1.Cl
InChIInChI=1S/C17H33N3O.ClH/c1-2-13-20(16-9-11-18-12-10-16)14-17(21)19-15-7-5-3-4-6-8-15;/h15-16,18H,2-14H2,1H3,(H,19,21);1H
InChIKeyKEGIPWBTQOUSCX-UHFFFAOYSA-N
XLogP2.71
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 ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylcyclohexyl)-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119933013
N-(4-methylcyclohexyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921661
N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 63304196
N-ethyl-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60807335
2-[azetidin-3-yl(propyl)amino]-N-cyclopropylacetamide
CID 66216105
1-cyclohexyl-2-[piperidin-4-yl(propyl)amino]ethanone
CID 104750584
N-cyclopentyl-2-[piperidin-4-yl(2,2,2-trifluoroethyl)amino]acetamide
CID 64850629
N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119922828
N-(cyclopentylcarbamoyl)-2-[ethyl(piperidin-4-yl)amino]acetamide
CID 60807146
2-[cyclohexyl(2-hydroxyethyl)amino]-N-cyclopentylacetamide
CID 60694014
N-(cyclopropylmethyl)-2-[piperidin-4-yl(propyl)amino]acetamide
CID 60806815
2-[2-aminoethyl(cyclobutyl)amino]-N-cycloheptylacetamide
CID 102875096

Frequently Asked Questions

What is the IUPAC name of N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
The IUPAC name of N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride (CID 119933007) is N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride.
What is the SMILES notation for N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
The canonical SMILES for N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride is CCCN(CC(=O)NC1CCCCCC1)C1CCNCC1.Cl.
What is the InChIKey of N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
The InChIKey is KEGIPWBTQOUSCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33N3O.ClH/c1-2-13-20(16-9-11-18-12-10-16)14-17(21)19-15-7-5-3-4-6-8-15;/h15-16,18H,2-14H2,1H3,(H,19,21);1H.
What are the key properties of N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride?
N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride has a molecular weight of 331.93 g/mol, XLogP of 2.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride is sourced from PubChem (CID 119933007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).