N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide

C17H26N2O — CID 105060394

IUPACN-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide
SMILESCCC1(C(=O)NC(C)(CN)c2ccccc2)CCCC1
InChIInChI=1S/C17H26N2O/c1-3-17(11-7-8-12-17)15(20)19-16(2,13-18)14-9-5-4-6-10-14/h4-6,9-10H,3,7-8,11-13,18H2,1-2H3,(H,19,20)
InChIKeyPDRSFSWDTNGUJF-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.95
Rot. Bonds5

About N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide

N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide (PubChem CID 105060394) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide
PubChem CID105060394
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide
SMILESCCC1(C(=O)NC(C)(CN)c2ccccc2)CCCC1
InChIInChI=1S/C17H26N2O/c1-3-17(11-7-8-12-17)15(20)19-16(2,13-18)14-9-5-4-6-10-14/h4-6,9-10H,3,7-8,11-13,18H2,1-2H3,(H,19,20)
InChIKeyPDRSFSWDTNGUJF-UHFFFAOYSA-N
XLogP2.95
TPSA55.12 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 ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-amino-2-phenylpropan-2-yl)-3-cyclopentylpropanamide
CID 105060455
N-(3-amino-2,2-dimethylpropyl)-1-ethylcyclopentane-1-carboxamide
CID 115365659
N-(1-amino-2-phenylpropan-2-yl)-3,3,3-trifluoropropanamide
CID 105060471
N-(1-amino-2-phenylpropan-2-yl)heptanamide
CID 105060397
N-(1-amino-2-phenylpropan-2-yl)-4-methylbenzamide
CID 105060436
N-(1-amino-2-phenylpropan-2-yl)-3-methylpiperidine-1-carboxamide
CID 105060539
N-(1-amino-2-phenylpropan-2-yl)-2-fluorobenzamide
CID 105060348
N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide
CID 105059163
N-(1-amino-2-phenylpropan-2-yl)-3-fluorobenzamide
CID 105060344
N-(1-amino-2-phenylpropan-2-yl)-2-methylfuran-3-carboxamide
CID 105060475
1-ethyl-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]cyclopentane-1-carboxamide
CID 102677400
N-[3-(aminomethyl)pentan-3-yl]-1-phenylcyclopropane-1-carboxamide
CID 63765721

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide?
The IUPAC name of N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide (CID 105060394) is N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide?
The canonical SMILES for N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide is CCC1(C(=O)NC(C)(CN)c2ccccc2)CCCC1.
What is the InChIKey of N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide?
The InChIKey is PDRSFSWDTNGUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-3-17(11-7-8-12-17)15(20)19-16(2,13-18)14-9-5-4-6-10-14/h4-6,9-10H,3,7-8,11-13,18H2,1-2H3,(H,19,20).
What are the key properties of N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide?
N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 2.95, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-phenylpropan-2-yl)-1-ethylcyclopentane-1-carboxamide is sourced from PubChem (CID 105060394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).