N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide

C16H22ClN3O — CID 104979253

IUPACN-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide
SMILESO=C(CN(CC1CCCN1)C1CC1)Nc1ccccc1Cl
InChIInChI=1S/C16H22ClN3O/c17-14-5-1-2-6-15(14)19-16(21)11-20(13-7-8-13)10-12-4-3-9-18-12/h1-2,5-6,12-13,18H,3-4,7-11H2,(H,19,21)
InChIKeyCGUKEYHYBCRRQN-UHFFFAOYSA-N
MW307.82 g/mol
LogP2.49
Rot. Bonds6

About N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide

N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide (PubChem CID 104979253) has the molecular formula C16H22ClN3O and a molecular weight of 307.82 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide
PubChem CID104979253
Molecular FormulaC16H22ClN3O
Molecular Weight307.82 g/mol
Exact Mass307.15
IUPAC NameN-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide
SMILESO=C(CN(CC1CCCN1)C1CC1)Nc1ccccc1Cl
InChIInChI=1S/C16H22ClN3O/c17-14-5-1-2-6-15(14)19-16(21)11-20(13-7-8-13)10-12-4-3-9-18-12/h1-2,5-6,12-13,18H,3-4,7-11H2,(H,19,21)
InChIKeyCGUKEYHYBCRRQN-UHFFFAOYSA-N
XLogP2.49
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.82
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-chlorophenyl)-3-[methyl(piperidin-2-ylmethyl)amino]propanamide
CID 106635404
N-(4-bromophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 103519927
N-(2-chlorophenyl)-2-[cyclopentyl(2-phenylethyl)amino]acetamide
CID 51128255
2-[azetidin-3-yl(ethyl)amino]-N-(2-chlorophenyl)acetamide
CID 66183463
N-(2-methoxyphenyl)-2-[methyl(pyrrolidin-2-ylmethyl)amino]acetamide
CID 106613869
2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-N-(5-methyl-1,3,4-oxadiazol-2-yl)acetamide
CID 106599752
N-[(2,6-dichlorophenyl)methyl]-N-(piperidin-2-ylmethyl)cyclopropanamine
CID 106621780
N-(2-chlorophenyl)-2-[cyclopropyl-(1-ethylpiperidin-4-yl)amino]acetamide
CID 75393855
2-[methyl(pyrrolidin-2-ylmethyl)amino]-N-(2,4,6-trichlorophenyl)acetamide
CID 106613623
1-cyclopropyl-3-(2-fluorophenyl)-1-(piperidin-2-ylmethyl)urea
CID 106629687
N-(2-chlorophenyl)-3-[methyl(piperidin-3-yl)amino]propanamide
CID 63644278
N-(2-bromophenyl)-2-pyrrolidin-2-ylacetamide
CID 61371785

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide (CID 104979253) is N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide is O=C(CN(CC1CCCN1)C1CC1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide?
The InChIKey is CGUKEYHYBCRRQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22ClN3O/c17-14-5-1-2-6-15(14)19-16(21)11-20(13-7-8-13)10-12-4-3-9-18-12/h1-2,5-6,12-13,18H,3-4,7-11H2,(H,19,21).
What are the key properties of N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide?
N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide has a molecular weight of 307.82 g/mol, XLogP of 2.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 104979253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).