(2S)-2-amino-N-tert-butyl-4-methylpentanamide

C10H22N2O — CID 14150757

IUPAC(2S)-2-amino-N-tert-butyl-4-methylpentanamide
SMILESCC(C)C[C@H](N)C(=O)NC(C)(C)C
InChIInChI=1S/C10H22N2O/c1-7(2)6-8(11)9(13)12-10(3,4)5/h7-8H,6,11H2,1-5H3,(H,12,13)/t8-/m0/s1
InChIKeyUDNNFSOGRPHDPH-QMMMGPOBSA-N
MW186.30 g/mol
LogP1.27
Rot. Bonds3

About (2S)-2-amino-N-tert-butyl-4-methylpentanamide

(2S)-2-amino-N-tert-butyl-4-methylpentanamide (PubChem CID 14150757) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is (2S)-2-amino-N-tert-butyl-4-methylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-tert-butyl-4-methylpentanamide
PubChem CID14150757
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name(2S)-2-amino-N-tert-butyl-4-methylpentanamide
SMILESCC(C)C[C@H](N)C(=O)NC(C)(C)C
InChIInChI=1S/C10H22N2O/c1-7(2)6-8(11)9(13)12-10(3,4)5/h7-8H,6,11H2,1-5H3,(H,12,13)/t8-/m0/s1
InChIKeyUDNNFSOGRPHDPH-QMMMGPOBSA-N
XLogP1.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
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

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-tert-butyl-4-methylpentanamide?
The IUPAC name of (2S)-2-amino-N-tert-butyl-4-methylpentanamide (CID 14150757) is (2S)-2-amino-N-tert-butyl-4-methylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-tert-butyl-4-methylpentanamide?
The canonical SMILES for (2S)-2-amino-N-tert-butyl-4-methylpentanamide is CC(C)C[C@H](N)C(=O)NC(C)(C)C.
What is the InChIKey of (2S)-2-amino-N-tert-butyl-4-methylpentanamide?
The InChIKey is UDNNFSOGRPHDPH-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H22N2O/c1-7(2)6-8(11)9(13)12-10(3,4)5/h7-8H,6,11H2,1-5H3,(H,12,13)/t8-/m0/s1.
What are the key properties of (2S)-2-amino-N-tert-butyl-4-methylpentanamide?
(2S)-2-amino-N-tert-butyl-4-methylpentanamide has a molecular weight of 186.30 g/mol, XLogP of 1.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-tert-butyl-4-methylpentanamide is sourced from PubChem (CID 14150757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).