2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide

C16H23N3O — CID 60928462

IUPAC2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(CNCC1CC1)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C16H23N3O/c20-16(12-17-11-13-6-7-13)18-14-4-3-5-15(10-14)19-8-1-2-9-19/h3-5,10,13,17H,1-2,6-9,11-12H2,(H,18,20)
InChIKeyNGODJHKUKNLGJQ-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.22
Rot. Bonds6

About 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide

2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 60928462) has the molecular formula C16H23N3O and a molecular weight of 273.38 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
PubChem CID60928462
Molecular FormulaC16H23N3O
Molecular Weight273.38 g/mol
Exact Mass273.18
IUPAC Name2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(CNCC1CC1)Nc1cccc(N2CCCC2)c1
InChIInChI=1S/C16H23N3O/c20-16(12-17-11-13-6-7-13)18-14-4-3-5-15(10-14)19-8-1-2-9-19/h3-5,10,13,17H,1-2,6-9,11-12H2,(H,18,20)
InChIKeyNGODJHKUKNLGJQ-UHFFFAOYSA-N
XLogP2.22
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)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

2-(methylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 54862520
2-piperidin-4-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 61030185
2-(azetidin-3-yl)-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 64616785
N-[3-(azepan-1-yl)phenyl]-2-(2-methoxyethylamino)acetamide
CID 119892181
N-[3-(azepan-1-yl)phenyl]-2-(methylamino)acetamide;hydrochloride
CID 120704662
2-(cyclopropylmethylamino)-N-(3-pyrazol-1-ylphenyl)acetamide
CID 60868167
2-chloro-N-(3-piperidin-1-ylphenyl)acetamide
CID 43822445
2-amino-N-[3-(azepan-1-yl)phenyl]acetamide
CID 119892163
2-(cyclopropylmethylamino)-N-(3-fluorophenyl)acetamide
CID 28566886
2-(cyclopropylmethylamino)-N-(3-pyrazol-1-ylphenyl)acetamide;hydrochloride
CID 119708752
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 61365428
3-(cyclopropylamino)-N-(3-pyrrolidin-1-ylphenyl)propanamide
CID 60926982

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide (CID 60928462) is 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide is O=C(CNCC1CC1)Nc1cccc(N2CCCC2)c1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is NGODJHKUKNLGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O/c20-16(12-17-11-13-6-7-13)18-14-4-3-5-15(10-14)19-8-1-2-9-19/h3-5,10,13,17H,1-2,6-9,11-12H2,(H,18,20).
What are the key properties of 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide?
2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 273.38 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(3-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 60928462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).