(1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide

C17H26N2O — CID 143582335

IUPAC(1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)[C@H]1CCCC1N[C@H](C)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-12(2)18-17(20)15-10-7-11-16(15)19-13(3)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16,19H,7,10-11H2,1-3H3,(H,18,20)/t13-,15+,16?/m1/s1
InChIKeyOLRADZDVOZJDKI-YISXUXMPSA-N
MW274.41 g/mol
LogP3.03
Rot. Bonds5

About (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide

(1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide (PubChem CID 143582335) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name(1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide
PubChem CID143582335
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name(1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide
SMILESCC(C)NC(=O)[C@H]1CCCC1N[C@H](C)c1ccccc1
InChIInChI=1S/C17H26N2O/c1-12(2)18-17(20)15-10-7-11-16(15)19-13(3)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16,19H,7,10-11H2,1-3H3,(H,18,20)/t13-,15+,16?/m1/s1
InChIKeyOLRADZDVOZJDKI-YISXUXMPSA-N
XLogP3.03
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 ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide with MolForge

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Related Compounds

trans-(1S,2S)-2-[[(1S)-1-phenylethyl]amino]cyclopentane-1-carboxylic acid
CID 11020794
trans-(1R,2R)-2-[[(1R)-1-phenylethyl]amino]cyclopentane-1-carboxylic acid
CID 10933381
1-N,2-N-bis(1-phenylethyl)cyclopentane-1,2-diamine
CID 23154294
trans-(1R,2R)-N-propan-2-yl-2-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 168834989
trans-(1R,2R)-2-[[(1R)-1-phenylethyl]amino]cyclopentan-1-ol
CID 10171980
trans-(1R,2R)-2-[[(1S)-1-phenylethyl]amino]cyclopentan-1-ol
CID 10035860
2-amino-N-[(1S)-1-phenylethyl]cyclopentane-1-carboxamide
CID 64851455
cis-(1R,2S)-2-methyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 95377362
trans-(1S,2S)-2-methyl-N-[(1S)-1-phenylethyl]cyclopentan-1-amine
CID 95377360
2-amino-N-[(1R)-1-phenylethyl]cyclohexane-1-carboxamide
CID 79001242
2-(aminomethyl)-N-[(1R)-1-phenylethyl]cyclopentane-1-carboxamide
CID 79025906
cis-(1S,2S)-2-ethyl-N-[(1S)-1-phenylethyl]cyclohexan-1-amine;trans-ethyl (1S,2S)-2-[[(1S)-1-phenylethyl]amino]cyclohexane-1-carboxylate
CID 159534838

Frequently Asked Questions

What is the IUPAC name of (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide?
The IUPAC name of (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide (CID 143582335) is (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide.
What is the SMILES notation for (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide?
The canonical SMILES for (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide is CC(C)NC(=O)[C@H]1CCCC1N[C@H](C)c1ccccc1.
What is the InChIKey of (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide?
The InChIKey is OLRADZDVOZJDKI-YISXUXMPSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12(2)18-17(20)15-10-7-11-16(15)19-13(3)14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16,19H,7,10-11H2,1-3H3,(H,18,20)/t13-,15+,16?/m1/s1.
What are the key properties of (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide?
(1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-[[(1R)-1-phenylethyl]amino]-N-propan-2-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 143582335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).