N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide

C13H26N2O2 — CID 114168417

IUPACN-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide
SMILESCCC(CC)C(O)CNC(C)C(=O)NC1CC1
InChIInChI=1S/C13H26N2O2/c1-4-10(5-2)12(16)8-14-9(3)13(17)15-11-6-7-11/h9-12,14,16H,4-8H2,1-3H3,(H,15,17)
InChIKeyQTZBMIMVFVLQQK-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.04
Rot. Bonds8

About N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide

N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide (PubChem CID 114168417) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide
PubChem CID114168417
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide
SMILESCCC(CC)C(O)CNC(C)C(=O)NC1CC1
InChIInChI=1S/C13H26N2O2/c1-4-10(5-2)12(16)8-14-9(3)13(17)15-11-6-7-11/h9-12,14,16H,4-8H2,1-3H3,(H,15,17)
InChIKeyQTZBMIMVFVLQQK-UHFFFAOYSA-N
XLogP1.04
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.04
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide
CID 106286124
3-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-2-hydroxypropanamide
CID 106174838
N-cyclopentyl-2-(2-hydroxypropylamino)propanamide
CID 43389370
N-butyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide
CID 114168386
2-(but-2-ynylamino)-N-cyclopropylpropanamide
CID 115865749
N-cyclopropyl-2-[(1-methylcyclopropyl)methylamino]propanamide
CID 103724718
N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394773
3-amino-N-cyclopropyl-2-hydroxypentanamide;hydrochloride
CID 67385613
2-[[2-(cyclopentylamino)-2-oxoethyl]amino]-N-cyclopropylpropanamide
CID 113248238
N-cyclopropyl-2-(3-fluoropropylamino)propanamide
CID 115731798
N-cyclopropyl-2-ethylbutanamide
CID 5151098
N-cyclopropyl-2-[(2-hydroxy-2-methylpentyl)amino]propanamide
CID 106293038

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide (CID 114168417) is N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide is CCC(CC)C(O)CNC(C)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide?
The InChIKey is QTZBMIMVFVLQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-4-10(5-2)12(16)8-14-9(3)13(17)15-11-6-7-11/h9-12,14,16H,4-8H2,1-3H3,(H,15,17).
What are the key properties of N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide?
N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide has a molecular weight of 242.36 g/mol, XLogP of 1.04, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(3-ethyl-2-hydroxypentyl)amino]propanamide is sourced from PubChem (CID 114168417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).