N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide

C17H26N2O — CID 115917194

IUPACN-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide
SMILESCCC1CCCC1Nc1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C17H26N2O/c1-4-13-6-5-7-16(13)18-14-8-10-15(11-9-14)19-17(20)12(2)3/h8-13,16,18H,4-7H2,1-3H3,(H,19,20)
InChIKeyCWXFDDQKTOUJPU-UHFFFAOYSA-N
MW274.41 g/mol
LogP4.27
Rot. Bonds5

About N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide

N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide (PubChem CID 115917194) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide
PubChem CID115917194
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide
SMILESCCC1CCCC1Nc1ccc(NC(=O)C(C)C)cc1
InChIInChI=1S/C17H26N2O/c1-4-13-6-5-7-16(13)18-14-8-10-15(11-9-14)19-17(20)12(2)3/h8-13,16,18H,4-7H2,1-3H3,(H,19,20)
InChIKeyCWXFDDQKTOUJPU-UHFFFAOYSA-N
XLogP4.27
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylcyclohexyl)-4-propan-2-ylaniline
CID 63862131
3-[(2-ethylcyclopentyl)amino]-N-propan-2-ylbenzamide
CID 115928884
N-[4-[(1-ethylpiperidin-4-yl)amino]phenyl]-2-methylpropanamide
CID 43683732
N-(2-ethylcyclohexyl)pyridin-4-amine
CID 61469829
5-[(2-ethylcyclohexyl)amino]pyridine-2-carboxylic acid
CID 115490737
4-[(2-ethylcyclohexyl)amino]-2-methylbenzoic acid
CID 81281868
N-[4-(2-ethylpiperidin-1-yl)phenyl]-2-methylpropanamide
CID 112985421
tert-butyl N-[4-[[2-(aminomethyl)cyclopentyl]amino]phenyl]carbamate
CID 107240491
3-[(2-ethylcyclopentyl)amino]-N,N-dimethylbenzamide
CID 115928650
2-methyl-N-[4-(thiolan-3-ylamino)phenyl]propanamide
CID 43683733
1-[4-[[2-(hydroxymethyl)cyclohexyl]amino]phenyl]propan-1-one
CID 106362345
2-methyl-N-[4-(oxolan-3-ylamino)phenyl]propanamide
CID 55200964

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide?
The IUPAC name of N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide (CID 115917194) is N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide.
What is the SMILES notation for N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide?
The canonical SMILES for N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide is CCC1CCCC1Nc1ccc(NC(=O)C(C)C)cc1.
What is the InChIKey of N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide?
The InChIKey is CWXFDDQKTOUJPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-13-6-5-7-16(13)18-14-8-10-15(11-9-14)19-17(20)12(2)3/h8-13,16,18H,4-7H2,1-3H3,(H,19,20).
What are the key properties of N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide?
N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide has a molecular weight of 274.41 g/mol, XLogP of 4.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-ethylcyclopentyl)amino]phenyl]-2-methylpropanamide is sourced from PubChem (CID 115917194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).