2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide

C14H30N2O — CID 62201162

IUPAC2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
SMILESCCCCC(C)NC(C)C(=O)NC(C)CCC
InChIInChI=1S/C14H30N2O/c1-6-8-10-12(4)15-13(5)14(17)16-11(3)9-7-2/h11-13,15H,6-10H2,1-5H3,(H,16,17)
InChIKeyFBOCHHHBTOUXDF-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.85
Rot. Bonds9

About 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide

2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide (PubChem CID 62201162) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
PubChem CID62201162
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
SMILESCCCCC(C)NC(C)C(=O)NC(C)CCC
InChIInChI=1S/C14H30N2O/c1-6-8-10-12(4)15-13(5)14(17)16-11(3)9-7-2/h11-13,15H,6-10H2,1-5H3,(H,16,17)
InChIKeyFBOCHHHBTOUXDF-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-2-(heptan-2-ylamino)propanamide
CID 54950626
2-[[1-oxo-1-(pentan-2-ylamino)propan-2-yl]amino]propanoic acid
CID 43467311
N-butan-2-yl-2-(6-methylheptan-2-ylamino)propanamide
CID 60719517
2-(octan-2-ylamino)-N-pentylpropanamide
CID 61476673
2-(1-hydroxybutan-2-ylamino)-N-pentan-2-ylpropanamide
CID 43416457
N-(2-methylpropyl)-2-(pentan-2-ylamino)propanamide
CID 43087379
2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide
CID 43420322
2-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-N-pentan-2-ylpropanamide
CID 103108377
2-(heptan-2-ylamino)-N-(methylcarbamoyl)propanamide
CID 60677131
N-(3-methylbutyl)-2-(octan-2-ylamino)propanamide
CID 61476708
N-hexan-2-ylbutanamide
CID 64592038
2-(nonan-2-ylamino)propanoic acid
CID 61499682

Frequently Asked Questions

What is the IUPAC name of 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide?
The IUPAC name of 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide (CID 62201162) is 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide is CCCCC(C)NC(C)C(=O)NC(C)CCC.
What is the InChIKey of 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide?
The InChIKey is FBOCHHHBTOUXDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-6-8-10-12(4)15-13(5)14(17)16-11(3)9-7-2/h11-13,15H,6-10H2,1-5H3,(H,16,17).
What are the key properties of 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide?
2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide has a molecular weight of 242.41 g/mol, XLogP of 2.85, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide is sourced from PubChem (CID 62201162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).