N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide

C18H26N2O2 — CID 110015008

IUPACN-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide
SMILESCN(c1ccccc1NC(=O)C1CCCC1O)C1CCCC1
InChIInChI=1S/C18H26N2O2/c1-20(13-7-2-3-8-13)16-11-5-4-10-15(16)19-18(22)14-9-6-12-17(14)21/h4-5,10-11,13-14,17,21H,2-3,6-9,12H2,1H3,(H,19,22)
InChIKeyKCGXQJXTFKGUJS-UHFFFAOYSA-N
MW302.42 g/mol
LogP3.16
Rot. Bonds4

About N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide

N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide (PubChem CID 110015008) has the molecular formula C18H26N2O2 and a molecular weight of 302.42 g/mol. Its IUPAC name is N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide
PubChem CID110015008
Molecular FormulaC18H26N2O2
Molecular Weight302.42 g/mol
Exact Mass302.20
IUPAC NameN-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide
SMILESCN(c1ccccc1NC(=O)C1CCCC1O)C1CCCC1
InChIInChI=1S/C18H26N2O2/c1-20(13-7-2-3-8-13)16-11-5-4-10-15(16)19-18(22)14-9-6-12-17(14)21/h4-5,10-11,13-14,17,21H,2-3,6-9,12H2,1H3,(H,19,22)
InChIKeyKCGXQJXTFKGUJS-UHFFFAOYSA-N
XLogP3.16
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.42
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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-[cyclopentyl(methyl)amino]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119899295
4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]butanamide
CID 119899319
2-hydroxy-N-(2-methoxyphenyl)cyclopentane-1-carboxamide
CID 110013580
3-[2-[cyclopentyl(methyl)amino]phenyl]-1-(4-hydroxy-2,2-dimethylbutyl)-1-methylurea
CID 75397403
4-amino-N-[2-[cyclopentyl(methyl)amino]phenyl]-3-methoxybutanamide
CID 120597455
4-[[2-[cyclopentyl(methyl)amino]phenyl]carbamoylamino]butanoic acid
CID 122086913
2-[2-[cyclopentyl(methyl)amino]anilino]-N-methyl-N-phenylacetamide
CID 71849650
3-[2-[cyclopentyl(methyl)amino]phenyl]-1-methyl-1-[[(3R)-oxolan-3-yl]methyl]urea
CID 97061195
N-[3-[(2-hydroxycyclopentanecarbonyl)amino]-2-methylphenyl]benzamide
CID 110015368
N-[2-(dimethylamino)-5-(trifluoromethyl)phenyl]-2-hydroxycyclopentane-1-carboxamide
CID 110015166

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide?
The IUPAC name of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide (CID 110015008) is N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide.
What is the SMILES notation for N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide?
The canonical SMILES for N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide is CN(c1ccccc1NC(=O)C1CCCC1O)C1CCCC1.
What is the InChIKey of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide?
The InChIKey is KCGXQJXTFKGUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O2/c1-20(13-7-2-3-8-13)16-11-5-4-10-15(16)19-18(22)14-9-6-12-17(14)21/h4-5,10-11,13-14,17,21H,2-3,6-9,12H2,1H3,(H,19,22).
What are the key properties of N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide?
N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide has a molecular weight of 302.42 g/mol, XLogP of 3.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclopentyl(methyl)amino]phenyl]-2-hydroxycyclopentane-1-carboxamide is sourced from PubChem (CID 110015008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).