2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide

C14H30N2O — CID 106328554

IUPAC2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NC(C)(CC)CC
InChIInChI=1S/C14H30N2O/c1-7-10-11(4)15-13(17)12(5)16-14(6,8-2)9-3/h11-12,16H,7-10H2,1-6H3,(H,15,17)
InChIKeyYTVSHNCWGOGLIC-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.85
Rot. Bonds8

About 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide

2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide (PubChem CID 106328554) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide
PubChem CID106328554
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NC(C)(CC)CC
InChIInChI=1S/C14H30N2O/c1-7-10-11(4)15-13(17)12(5)16-14(6,8-2)9-3/h11-12,16H,7-10H2,1-6H3,(H,15,17)
InChIKeyYTVSHNCWGOGLIC-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
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

2-(3-methylpentan-3-ylamino)propanoic acid
CID 103829131
2-[[1-oxo-1-(pentan-2-ylamino)propan-2-yl]amino]propanoic acid
CID 43467311
2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
CID 62201162
2-bromo-N-pentan-2-ylpropanamide
CID 81222887
2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-N-pentan-2-ylpropanamide
CID 105057950
2-[[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]amino]-N-pentan-2-ylpropanamide
CID 103108377
2-[2-(diethylamino)ethylamino]-N-pentan-2-ylpropanamide
CID 43112761
N-ethyl-2-[(1-hydroxy-2-methylbutan-2-yl)amino]propanamide
CID 64550594
2-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-pentan-2-ylpropanamide
CID 43420332
N-pentan-2-yl-2-(prop-2-enylamino)propanamide
CID 43113010
3-methyl-3-(pentan-2-ylamino)butanoic acid
CID 107886489
2-(4-methylpentylamino)-N-pentan-2-ylpropanamide
CID 60745937

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide?
The IUPAC name of 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide (CID 106328554) is 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)NC(C)(CC)CC.
What is the InChIKey of 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide?
The InChIKey is YTVSHNCWGOGLIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-7-10-11(4)15-13(17)12(5)16-14(6,8-2)9-3/h11-12,16H,7-10H2,1-6H3,(H,15,17).
What are the key properties of 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide?
2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide has a molecular weight of 242.41 g/mol, XLogP of 2.85, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylpentan-3-ylamino)-N-pentan-2-ylpropanamide is sourced from PubChem (CID 106328554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).