N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride

C17H25ClN2O — CID 119807499

IUPACN-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCl.O=C(CC1CCCN1)N(CC1CCC1)c1ccccc1
InChIInChI=1S/C17H24N2O.ClH/c20-17(12-15-8-5-11-18-15)19(13-14-6-4-7-14)16-9-2-1-3-10-16;/h1-3,9-10,14-15,18H,4-8,11-13H2;1H
InChIKeyMMECJBUVLOWBDE-UHFFFAOYSA-N
MW308.85 g/mol
LogP3.38
Rot. Bonds5

About N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride

N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride (PubChem CID 119807499) has the molecular formula C17H25ClN2O and a molecular weight of 308.85 g/mol. Its IUPAC name is N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride
PubChem CID119807499
Molecular FormulaC17H25ClN2O
Molecular Weight308.85 g/mol
Exact Mass308.17
IUPAC NameN-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride
SMILESCl.O=C(CC1CCCN1)N(CC1CCC1)c1ccccc1
InChIInChI=1S/C17H24N2O.ClH/c20-17(12-15-8-5-11-18-15)19(13-14-6-4-7-14)16-9-2-1-3-10-16;/h1-3,9-10,14-15,18H,4-8,11-13H2;1H
InChIKeyMMECJBUVLOWBDE-UHFFFAOYSA-N
XLogP3.38
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.85
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 119337195
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N-(cyclobutylmethyl)-N-methyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119770691
N-(cyclobutylmethyl)-2-(cyclopropylmethylamino)-N-phenylacetamide
CID 119807486
N-benzyl-N-(4-methoxyphenyl)-2-pyrrolidin-2-ylacetamide
CID 119691210
N-(cyclobutylmethyl)-N-ethyl-2-pyrrolidin-2-ylacetamide
CID 107398386
1-phenyl-2-pyrrolidin-2-ylethanone
CID 14176779
N-(cyclobutylmethyl)-N-methyl-2-piperidin-2-ylacetamide
CID 115160515
N-phenyl-N-(pyrrolidin-2-ylmethyl)aniline
CID 69019447
N-(cyclopropylmethyl)-2-phenyl-N-(pyrrolidin-2-ylmethyl)acetamide
CID 106608735
N-methyl-N-(2-phenylethyl)-2-pyrrolidin-2-ylacetamide
CID 61365250
N-(2-amino-2-oxoethyl)-N-benzyl-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119783040

Frequently Asked Questions

What is the IUPAC name of N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
The IUPAC name of N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride (CID 119807499) is N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride is Cl.O=C(CC1CCCN1)N(CC1CCC1)c1ccccc1.
What is the InChIKey of N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
The InChIKey is MMECJBUVLOWBDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O.ClH/c20-17(12-15-8-5-11-18-15)19(13-14-6-4-7-14)16-9-2-1-3-10-16;/h1-3,9-10,14-15,18H,4-8,11-13H2;1H.
What are the key properties of N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride?
N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride has a molecular weight of 308.85 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclobutylmethyl)-N-phenyl-2-pyrrolidin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119807499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).