3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide

C15H24N2O2 — CID 65047695

IUPAC3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide
SMILESCOCC(NC(=O)C(CN)c1ccccc1)C(C)C
InChIInChI=1S/C15H24N2O2/c1-11(2)14(10-19-3)17-15(18)13(9-16)12-7-5-4-6-8-12/h4-8,11,13-14H,9-10,16H2,1-3H3,(H,17,18)
InChIKeyULGSNOBALMEJIQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.52
Rot. Bonds7

About 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide

3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide (PubChem CID 65047695) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide.

Molecular Properties

Compound Name3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide
PubChem CID65047695
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide
SMILESCOCC(NC(=O)C(CN)c1ccccc1)C(C)C
InChIInChI=1S/C15H24N2O2/c1-11(2)14(10-19-3)17-15(18)13(9-16)12-7-5-4-6-8-12/h4-8,11,13-14H,9-10,16H2,1-3H3,(H,17,18)
InChIKeyULGSNOBALMEJIQ-UHFFFAOYSA-N
XLogP1.52
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(4-hydroxy-1-methoxybutan-2-yl)-2-phenylpropanamide
CID 106161073
2-[(3-amino-2-phenylpropanoyl)amino]-3-methylbutanamide
CID 106344661
[(2R)-2-[(2-methoxy-2-phenylacetyl)amino]-3-methylbutyl] 2-methoxy-2-phenylacetate
CID 139251068
3-amino-N-(1-hydroxypropan-2-yl)-2-phenylpropanamide
CID 62877991
methyl (2R)-3-amino-2-phenylpropanoate
CID 7183129
3-amino-N-[(1R)-1-(2-methylphenyl)ethyl]-2-phenylpropanamide
CID 81363517
N-(1-amino-4-methylpentan-3-yl)-2-phenylbutanamide
CID 106356833
3-amino-N-(1,3-dihydroxypropan-2-yl)-2-phenylpropanamide
CID 65314592
3-amino-2-phenyl-N-(1-phenylpropyl)propanamide
CID 62878381
N-[(2S)-1-methoxy-3-methylbutan-2-yl]-3-phenylpropanamide
CID 56593002
3-amino-N-[(1S)-1-(4-fluorophenyl)ethyl]-2-phenylpropanamide
CID 81347787
3-amino-N-(2-hydroxy-3-methylbutyl)-2-phenylpropanamide
CID 113492233

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide?
The IUPAC name of 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide (CID 65047695) is 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide.
What is the SMILES notation for 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide?
The canonical SMILES for 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide is COCC(NC(=O)C(CN)c1ccccc1)C(C)C.
What is the InChIKey of 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide?
The InChIKey is ULGSNOBALMEJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)14(10-19-3)17-15(18)13(9-16)12-7-5-4-6-8-12/h4-8,11,13-14H,9-10,16H2,1-3H3,(H,17,18).
What are the key properties of 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide?
3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide has a molecular weight of 264.37 g/mol, XLogP of 1.52, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-methoxy-3-methylbutan-2-yl)-2-phenylpropanamide is sourced from PubChem (CID 65047695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).