N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide

C20H25N3O — CID 97334723

IUPACN-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide
SMILESC[C@H](NCC(=O)NC1CCCC1)c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C20H25N3O/c1-15(22-14-20(24)23-19-6-2-3-7-19)16-8-10-17(11-9-16)18-5-4-12-21-13-18/h4-5,8-13,15,19,22H,2-3,6-7,14H2,1H3,(H,23,24)/t15-/m0/s1
InChIKeyKBCWOZASMDBHQZ-HNNXBMFYSA-N
MW323.44 g/mol
LogP3.46
Rot. Bonds6

About N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide

N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide (PubChem CID 97334723) has the molecular formula C20H25N3O and a molecular weight of 323.44 g/mol. Its IUPAC name is N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide
PubChem CID97334723
Molecular FormulaC20H25N3O
Molecular Weight323.44 g/mol
Exact Mass323.20
IUPAC NameN-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide
SMILESC[C@H](NCC(=O)NC1CCCC1)c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C20H25N3O/c1-15(22-14-20(24)23-19-6-2-3-7-19)16-8-10-17(11-9-16)18-5-4-12-21-13-18/h4-5,8-13,15,19,22H,2-3,6-7,14H2,1H3,(H,23,24)/t15-/m0/s1
InChIKeyKBCWOZASMDBHQZ-HNNXBMFYSA-N
XLogP3.46
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.44
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]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-cyclopropyl-2-[[(1R)-1-pyridin-3-ylethyl]amino]acetamide
CID 81404358
N-cyclopentyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]acetamide
CID 81409773
N-cycloheptyl-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 63867372
2-[[(1R)-1-(4-bromophenyl)ethyl]amino]-N-cyclopentylacetamide
CID 81359637
2-[[(1S)-1-(4-bromophenyl)ethyl]amino]-N-cyclohexylacetamide
CID 81359177
N-(5-methyl-1,2-oxazol-3-yl)-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide
CID 124615499
2-(methylamino)-N-[1-(4-pyridin-3-ylphenyl)ethyl]acetamide
CID 120704866
2-[1-(4-bromophenyl)ethylamino]-N-cyclopropylacetamide
CID 43398074
N-cycloheptyl-2-[[(1R)-1-(3-methylphenyl)ethyl]amino]acetamide
CID 81367500
2-[1-(4-tert-butylphenyl)ethylamino]-N-cyclopropylacetamide
CID 43568343
N-[1-(4-pyridin-3-ylphenyl)ethyl]-2-pyrrolidin-2-ylacetamide;dihydrochloride
CID 119897485
2-[[(1R)-1-(3-bromophenyl)ethyl]amino]-N-cyclohexylacetamide
CID 81382580

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide (CID 97334723) is N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide is C[C@H](NCC(=O)NC1CCCC1)c1ccc(-c2cccnc2)cc1.
What is the InChIKey of N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide?
The InChIKey is KBCWOZASMDBHQZ-HNNXBMFYSA-N. The full InChI is InChI=1S/C20H25N3O/c1-15(22-14-20(24)23-19-6-2-3-7-19)16-8-10-17(11-9-16)18-5-4-12-21-13-18/h4-5,8-13,15,19,22H,2-3,6-7,14H2,1H3,(H,23,24)/t15-/m0/s1.
What are the key properties of N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide?
N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide has a molecular weight of 323.44 g/mol, XLogP of 3.46, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[[(1S)-1-(4-pyridin-3-ylphenyl)ethyl]amino]acetamide is sourced from PubChem (CID 97334723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).