N-(4-methylpentan-2-yl)-2-propylpentanamide

C14H29NO — CID 173327827

IUPACN-(4-methylpentan-2-yl)-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NC(C)CC(C)C
InChIInChI=1S/C14H29NO/c1-6-8-13(9-7-2)14(16)15-12(5)10-11(3)4/h11-13H,6-10H2,1-5H3,(H,15,16)
InChIKeyQDQOECWSPSUOIV-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.75
Rot. Bonds8

About N-(4-methylpentan-2-yl)-2-propylpentanamide

N-(4-methylpentan-2-yl)-2-propylpentanamide (PubChem CID 173327827) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is N-(4-methylpentan-2-yl)-2-propylpentanamide.

Molecular Properties

Compound NameN-(4-methylpentan-2-yl)-2-propylpentanamide
PubChem CID173327827
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC NameN-(4-methylpentan-2-yl)-2-propylpentanamide
SMILESCCCC(CCC)C(=O)NC(C)CC(C)C
InChIInChI=1S/C14H29NO/c1-6-8-13(9-7-2)14(16)15-12(5)10-11(3)4/h11-13H,6-10H2,1-5H3,(H,15,16)
InChIKeyQDQOECWSPSUOIV-UHFFFAOYSA-N
XLogP3.75
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-butan-2-yl-2-propylpentanamide
CID 115532227
N-(1-hydroxy-4-methylpentan-2-yl)-2-propylpentanamide
CID 82987600
N-butan-2-yl-2-propylhexanamide
CID 173163059
2-[(4-methylpentan-2-ylcarbamoylamino)methyl]pentanoic acid
CID 65223798
(2S)-2-amino-N-(4-methylpentan-2-yl)butanamide
CID 79025012
2-(methylamino)-N-(4-methylpentan-2-yl)propanamide
CID 62638556
2-bromo-N-pentan-2-ylpropanamide
CID 81222887
diethyl 2-(2-propylpentanoylamino)propanedioate
CID 82989756
(2S)-2-amino-N-heptan-2-yl-4-methylpentanamide
CID 61154397
6-amino-2-methyl-N-(4-methylpentan-2-yl)heptanamide
CID 65292557
N-(1-chloro-4,4-dimethylpentan-3-yl)-2-propylpentanamide
CID 106355550
N-(1-amino-3-methyl-1-sulfanylidenebutan-2-yl)-2-propylpentanamide
CID 82985436

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpentan-2-yl)-2-propylpentanamide?
The IUPAC name of N-(4-methylpentan-2-yl)-2-propylpentanamide (CID 173327827) is N-(4-methylpentan-2-yl)-2-propylpentanamide.
What is the SMILES notation for N-(4-methylpentan-2-yl)-2-propylpentanamide?
The canonical SMILES for N-(4-methylpentan-2-yl)-2-propylpentanamide is CCCC(CCC)C(=O)NC(C)CC(C)C.
What is the InChIKey of N-(4-methylpentan-2-yl)-2-propylpentanamide?
The InChIKey is QDQOECWSPSUOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-6-8-13(9-7-2)14(16)15-12(5)10-11(3)4/h11-13H,6-10H2,1-5H3,(H,15,16).
What are the key properties of N-(4-methylpentan-2-yl)-2-propylpentanamide?
N-(4-methylpentan-2-yl)-2-propylpentanamide has a molecular weight of 227.39 g/mol, XLogP of 3.75, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpentan-2-yl)-2-propylpentanamide is sourced from PubChem (CID 173327827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).