2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide

C12H26N2O2 — CID 81081647

IUPAC2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide
SMILESCCCN(C(=O)C(N)CCCOC)C(C)C
InChIInChI=1S/C12H26N2O2/c1-5-8-14(10(2)3)12(15)11(13)7-6-9-16-4/h10-11H,5-9,13H2,1-4H3
InChIKeyJPTIRYQRKJHXKN-UHFFFAOYSA-N
MW230.35 g/mol
LogP1.39
Rot. Bonds8

About 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide

2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide (PubChem CID 81081647) has the molecular formula C12H26N2O2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide.

Molecular Properties

Compound Name2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide
PubChem CID81081647
Molecular FormulaC12H26N2O2
Molecular Weight230.35 g/mol
Exact Mass230.20
IUPAC Name2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide
SMILESCCCN(C(=O)C(N)CCCOC)C(C)C
InChIInChI=1S/C12H26N2O2/c1-5-8-14(10(2)3)12(15)11(13)7-6-9-16-4/h10-11H,5-9,13H2,1-4H3
InChIKeyJPTIRYQRKJHXKN-UHFFFAOYSA-N
XLogP1.39
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-ethyl-5-methoxy-N-propan-2-ylpentanamide
CID 81081261
4-[(2-amino-5-methoxypentanoyl)-propan-2-ylamino]butanoic acid
CID 81089259
2-amino-N-butan-2-yl-5-methoxy-N-(2-methoxyethyl)pentanamide
CID 81088100
2-amino-N-butan-2-yl-N-ethyl-5-methoxypentanamide
CID 81082232
(2R)-2-amino-N-(2-methoxyethyl)-N-propan-2-ylbutanamide
CID 82949069
2-amino-5-methoxy-N-methyl-N-pentylpentanamide
CID 81082325
4-amino-5-oxo-5-[propan-2-yl(propyl)amino]pentanoic acid
CID 64896188
2-amino-5-methoxy-N-(3-methoxypropyl)-N-methylpentanamide
CID 81088448
(2R)-2-amino-4-methylsulfanyl-N-propan-2-yl-N-propylbutanamide
CID 104906933
(2R)-2-amino-N-(2-methoxyethyl)-4-methylsulfanyl-N-propan-2-ylbutanamide
CID 104908944
2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide
CID 81082818
methyl 2-[[(2S)-2-aminohexanoyl]-propan-2-ylamino]acetate
CID 93371915

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide?
The IUPAC name of 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide (CID 81081647) is 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide.
What is the SMILES notation for 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide?
The canonical SMILES for 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide is CCCN(C(=O)C(N)CCCOC)C(C)C.
What is the InChIKey of 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide?
The InChIKey is JPTIRYQRKJHXKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O2/c1-5-8-14(10(2)3)12(15)11(13)7-6-9-16-4/h10-11H,5-9,13H2,1-4H3.
What are the key properties of 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide?
2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide has a molecular weight of 230.35 g/mol, XLogP of 1.39, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide is sourced from PubChem (CID 81081647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).