N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide

C14H20N2O — CID 55251616

IUPACN-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide
SMILESCC(N[C@@H](C)c1ccccc1)C(=O)NC1CC1
InChIInChI=1S/C14H20N2O/c1-10(12-6-4-3-5-7-12)15-11(2)14(17)16-13-8-9-13/h3-7,10-11,13,15H,8-9H2,1-2H3,(H,16,17)/t10-,11?/m0/s1
InChIKeyIMTIRFLKACZNSI-VUWPPUDQSA-N
MW232.33 g/mol
LogP2.00
Rot. Bonds5

About N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide

N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide (PubChem CID 55251616) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide
PubChem CID55251616
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide
SMILESCC(N[C@@H](C)c1ccccc1)C(=O)NC1CC1
InChIInChI=1S/C14H20N2O/c1-10(12-6-4-3-5-7-12)15-11(2)14(17)16-13-8-9-13/h3-7,10-11,13,15H,8-9H2,1-2H3,(H,16,17)/t10-,11?/m0/s1
InChIKeyIMTIRFLKACZNSI-VUWPPUDQSA-N
XLogP2.00
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-2-(1-phenylethylamino)propanamide
CID 43085781
(2S)-2-(benzhydrylamino)-N-cyclopropylpropanamide
CID 7614348
2-[[(1S)-1-(4-chlorophenyl)ethyl]amino]-N-cyclopropylpropanamide
CID 81354478
(2S)-2-(benzhydrylamino)-N-cyclopentylpropanamide
CID 8005843
2-[1-(4-cyanophenyl)ethylamino]-N-cyclopropylpropanamide
CID 54936564
N-cyclopropyl-2-[1-(4-propylphenyl)ethylamino]propanamide
CID 115672864
N-methyl-2-[[(1S)-1-phenylethyl]amino]propanamide
CID 63866912
1-cyclopropyl-3-(1-phenylethyl)urea
CID 42924486
2-[[(1S)-1-(3-chlorophenyl)ethyl]amino]-N-cyclohexylpropanamide
CID 81371173
N-cyclopropyl-2-[1-[2-(trifluoromethyl)phenyl]ethylamino]propanamide
CID 115672845
2-(1-phenylethylamino)propanoic acid;hydrochloride
CID 75479950
N-ethyl-2-[[(1R)-1-phenylethyl]amino]propanamide
CID 78952919

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide (CID 55251616) is N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide is CC(N[C@@H](C)c1ccccc1)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
The InChIKey is IMTIRFLKACZNSI-VUWPPUDQSA-N. The full InChI is InChI=1S/C14H20N2O/c1-10(12-6-4-3-5-7-12)15-11(2)14(17)16-13-8-9-13/h3-7,10-11,13,15H,8-9H2,1-2H3,(H,16,17)/t10-,11?/m0/s1.
What are the key properties of N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide?
N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide has a molecular weight of 232.33 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[[(1S)-1-phenylethyl]amino]propanamide is sourced from PubChem (CID 55251616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).