4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide

C16H25N3O — CID 119899319

IUPAC4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide
SMILESCN(c1ccccc1NC(=O)CCCN)C1CCCC1
InChIInChI=1S/C16H25N3O/c1-19(13-7-2-3-8-13)15-10-5-4-9-14(15)18-16(20)11-6-12-17/h4-5,9-10,13H,2-3,6-8,11-12,17H2,1H3,(H,18,20)
InChIKeyQWOAQHYDZGUBNU-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.74
Rot. Bonds6

About 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide

4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide (PubChem CID 119899319) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide.

Molecular Properties

Compound Name4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide
PubChem CID119899319
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC Name4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide
SMILESCN(c1ccccc1NC(=O)CCCN)C1CCCC1
InChIInChI=1S/C16H25N3O/c1-19(13-7-2-3-8-13)15-10-5-4-9-14(15)18-16(20)11-6-12-17/h4-5,9-10,13H,2-3,6-8,11-12,17H2,1H3,(H,18,20)
InChIKeyQWOAQHYDZGUBNU-UHFFFAOYSA-N
XLogP2.74
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]-3-methoxybutanamide
CID 120597455
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119899295
2-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]propanamide;dihydrochloride
CID 119899288
2-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]pentanamide
CID 119899281
N-(2-aminophenyl)-4-[cyclohexyl(methyl)amino]butanamide
CID 16794531
4-[[2-[cyclopentyl(methyl)amino]phenyl]carbamoylamino]butanoic acid
CID 122086913
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide
CID 110015008
N-[2-(4-aminobutanoylamino)phenyl]cyclohexanecarboxamide
CID 39192948
4-amino-N-[2-(propan-2-ylcarbamoylamino)phenyl]butanamide
CID 119293073
5-amino-N-[2-(dimethylamino)phenyl]hexanamide
CID 82847991
2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide
CID 71849650
3-[2-[cyclopentyl(methyl)amino]phenyl]-1-(4-hydroxy-2,2-dimethylbutyl)-1-methylurea
CID 75397403

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide?
The IUPAC name of 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide (CID 119899319) is 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide.
What is the SMILES notation for 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide?
The canonical SMILES for 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide is CN(c1ccccc1NC(=O)CCCN)C1CCCC1.
What is the InChIKey of 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide?
The InChIKey is QWOAQHYDZGUBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-19(13-7-2-3-8-13)15-10-5-4-9-14(15)18-16(20)11-6-12-17/h4-5,9-10,13H,2-3,6-8,11-12,17H2,1H3,(H,18,20).
What are the key properties of 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide?
4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide has a molecular weight of 275.40 g/mol, XLogP of 2.74, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide is sourced from PubChem (CID 119899319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).