(2S)-2-amino-N-(5-methylhexan-2-yl)propanamide

C10H22N2O — CID 61146482

IUPAC(2S)-2-amino-N-(5-methylhexan-2-yl)propanamide
SMILESCC(C)CCC(C)NC(=O)[C@H](C)N
InChIInChI=1S/C10H22N2O/c1-7(2)5-6-8(3)12-10(13)9(4)11/h7-9H,5-6,11H2,1-4H3,(H,12,13)/t8?,9-/m0/s1
InChIKeyYMYHPFDKLOYPKR-GKAPJAKFSA-N
MW186.30 g/mol
LogP1.27
Rot. Bonds5

About (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide

(2S)-2-amino-N-(5-methylhexan-2-yl)propanamide (PubChem CID 61146482) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(5-methylhexan-2-yl)propanamide
PubChem CID61146482
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(2S)-2-amino-N-(5-methylhexan-2-yl)propanamide
SMILESCC(C)CCC(C)NC(=O)[C@H](C)N
InChIInChI=1S/C10H22N2O/c1-7(2)5-6-8(3)12-10(13)9(4)11/h7-9H,5-6,11H2,1-4H3,(H,12,13)/t8?,9-/m0/s1
InChIKeyYMYHPFDKLOYPKR-GKAPJAKFSA-N
XLogP1.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-[(2R)-1-aminopropan-2-yl]propanamide
CID 130611964
2-amino-N-[(2S)-1-hydroxypropan-2-yl]propanamide
CID 107219144
3-[[(2R)-2-aminopropanoyl]amino]butanoic acid
CID 78973363
(2R)-2-amino-N-heptan-2-ylpropanamide
CID 78972371
2-amino-N-(1-methylsulfanylpropan-2-yl)propanamide
CID 115734652
2-methyl-3-(methylamino)-N-(5-methylhexan-2-yl)propanamide
CID 79195498
2-amino-N-(5-methylhexan-2-yl)-2-phenylacetamide
CID 43579340
(2S)-2-amino-N-(1-cyanopropan-2-yl)propanamide
CID 62093737
2-amino-N-(5-methylhexan-2-yl)-2-(4-methylphenyl)acetamide
CID 106151106
(2R)-2-amino-N-(4-phenylbutan-2-yl)propanamide
CID 14620809
(2S)-2-amino-N-[5-(diethylamino)pentan-2-yl]propanamide
CID 61147751
(2R)-2-amino-N-(1-ethoxypropan-2-yl)propanamide
CID 78977149

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide?
The IUPAC name of (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide (CID 61146482) is (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide is CC(C)CCC(C)NC(=O)[C@H](C)N.
What is the InChIKey of (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide?
The InChIKey is YMYHPFDKLOYPKR-GKAPJAKFSA-N. The full InChI is InChI=1S/C10H22N2O/c1-7(2)5-6-8(3)12-10(13)9(4)11/h7-9H,5-6,11H2,1-4H3,(H,12,13)/t8?,9-/m0/s1.
What are the key properties of (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide?
(2S)-2-amino-N-(5-methylhexan-2-yl)propanamide has a molecular weight of 186.30 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(5-methylhexan-2-yl)propanamide is sourced from PubChem (CID 61146482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).