2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide

C13H26N2O — CID 43420322

IUPAC2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NC(C)C1CC1
InChIInChI=1S/C13H26N2O/c1-5-6-9(2)14-13(16)11(4)15-10(3)12-7-8-12/h9-12,15H,5-8H2,1-4H3,(H,14,16)
InChIKeySMIXTROMPRZCDS-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.07
Rot. Bonds7

About 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide

2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide (PubChem CID 43420322) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide.

Molecular Properties

Compound Name2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide
PubChem CID43420322
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide
SMILESCCCC(C)NC(=O)C(C)NC(C)C1CC1
InChIInChI=1S/C13H26N2O/c1-5-6-9(2)14-13(16)11(4)15-10(3)12-7-8-12/h9-12,15H,5-8H2,1-4H3,(H,14,16)
InChIKeySMIXTROMPRZCDS-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-butan-2-yl-2-[[(1S)-1-cyclopentylethyl]amino]propanamide
CID 81396140
2-(1-cyclopropylethylamino)-N-propylpropanamide
CID 43401278
2-[[1-oxo-1-(pentan-2-ylamino)propan-2-yl]amino]propanoic acid
CID 43467311
2-(1-cyclohexylethylamino)-N-pentan-3-ylpropanamide
CID 62405918
2-(hexan-2-ylamino)-N-pentan-2-ylpropanamide
CID 62201162
N-[(1S)-1-cyclopropylethyl]-2-methylpentanamide
CID 161003325
N-pentan-2-yl-2-(prop-2-enylamino)propanamide
CID 43113010
2-[(4-hydroxycyclohexyl)methylamino]-N-pentan-2-ylpropanamide
CID 106132906
N-carbamoyl-2-(1-cyclopropylethylamino)propanamide
CID 43401268
2-(1-hydroxybutan-2-ylamino)-N-pentan-2-ylpropanamide
CID 43416457
2-[(1-cyclopropylpyrrolidin-3-yl)methylamino]-N-pentan-2-ylpropanamide
CID 60975768
2-[(1,1-dioxothiolan-3-yl)methylamino]-N-pentan-2-ylpropanamide
CID 54914910

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide?
The IUPAC name of 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide (CID 43420322) is 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide.
What is the SMILES notation for 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide?
The canonical SMILES for 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide is CCCC(C)NC(=O)C(C)NC(C)C1CC1.
What is the InChIKey of 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide?
The InChIKey is SMIXTROMPRZCDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-5-6-9(2)14-13(16)11(4)15-10(3)12-7-8-12/h9-12,15H,5-8H2,1-4H3,(H,14,16).
What are the key properties of 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide?
2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide has a molecular weight of 226.36 g/mol, XLogP of 2.07, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylethylamino)-N-pentan-2-ylpropanamide is sourced from PubChem (CID 43420322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).