(2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide

C16H26N2O — CID 119273049

IUPAC(2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide
SMILESCCCc1ccc(C(NC(=O)[C@@H](C)N)C(C)C)cc1
InChIInChI=1S/C16H26N2O/c1-5-6-13-7-9-14(10-8-13)15(11(2)3)18-16(19)12(4)17/h7-12,15H,5-6,17H2,1-4H3,(H,18,19)/t12-,15?/m1/s1
InChIKeyNDLBCVPWCXIMKI-KEKZHRQWSA-N
MW262.40 g/mol
LogP2.80
Rot. Bonds6

About (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide

(2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide (PubChem CID 119273049) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide
PubChem CID119273049
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name(2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide
SMILESCCCc1ccc(C(NC(=O)[C@@H](C)N)C(C)C)cc1
InChIInChI=1S/C16H26N2O/c1-5-6-13-7-9-14(10-8-13)15(11(2)3)18-16(19)12(4)17/h7-12,15H,5-6,17H2,1-4H3,(H,18,19)/t12-,15?/m1/s1
InChIKeyNDLBCVPWCXIMKI-KEKZHRQWSA-N
XLogP2.80
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-amino-N-(2-methyl-1-phenylpropyl)propanamide;hydrochloride
CID 119273389
2-amino-N-(4-propylphenyl)propanamide
CID 43378686
(2S)-N-carbamoyl-2-[[(1R)-2-methyl-1-(4-propylphenyl)propyl]amino]propanamide
CID 8970695
1-methyl-3-[(1S)-2-methyl-1-(4-propylphenyl)propyl]thiourea
CID 9284138
N,N-dimethyl-2-[[2-methyl-1-(4-propylphenyl)propyl]amino]acetamide
CID 78818491
(2S,3S)-2-amino-N-[1-(4-ethylphenyl)-2-methylpropyl]-3-methylpentanamide
CID 61273458
2-amino-N-[1-(4-butylphenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119272781
3-amino-N-[2-methyl-1-(4-propylphenyl)propyl]cyclopentane-1-carboxamide
CID 119692874
N-[2-methyl-1-(4-propylphenyl)propyl]piperidine-4-carboxamide
CID 119273047
1-(4-butylphenyl)-N-ethyl-2-methylpropan-1-amine
CID 43393753
(2S)-2-amino-N-[1-(4-fluorophenyl)-2-methylpropyl]butanamide
CID 79024949
(3R)-3-amino-3-(4-propylphenyl)propanoic acid
CID 95997919

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide (CID 119273049) is (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide is CCCc1ccc(C(NC(=O)[C@@H](C)N)C(C)C)cc1.
What is the InChIKey of (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide?
The InChIKey is NDLBCVPWCXIMKI-KEKZHRQWSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-6-13-7-9-14(10-8-13)15(11(2)3)18-16(19)12(4)17/h7-12,15H,5-6,17H2,1-4H3,(H,18,19)/t12-,15?/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide?
(2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide has a molecular weight of 262.40 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-methyl-1-(4-propylphenyl)propyl]propanamide is sourced from PubChem (CID 119273049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).