2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide

C17H35N3O — CID 63910757

IUPAC2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide
SMILESCCCNC(CN(CC)CC(CC)CC)(C(N)=O)C1CC1
InChIInChI=1S/C17H35N3O/c1-5-11-19-17(16(18)21,15-9-10-15)13-20(8-4)12-14(6-2)7-3/h14-15,19H,5-13H2,1-4H3,(H2,18,21)
InChIKeyUXNANEKKXTWPIB-UHFFFAOYSA-N
MW297.49 g/mol
LogP2.38
Rot. Bonds12

About 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide

2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide (PubChem CID 63910757) has the molecular formula C17H35N3O and a molecular weight of 297.49 g/mol. Its IUPAC name is 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide
PubChem CID63910757
Molecular FormulaC17H35N3O
Molecular Weight297.49 g/mol
Exact Mass297.28
IUPAC Name2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide
SMILESCCCNC(CN(CC)CC(CC)CC)(C(N)=O)C1CC1
InChIInChI=1S/C17H35N3O/c1-5-11-19-17(16(18)21,15-9-10-15)13-20(8-4)12-14(6-2)7-3/h14-15,19H,5-13H2,1-4H3,(H2,18,21)
InChIKeyUXNANEKKXTWPIB-UHFFFAOYSA-N
XLogP2.38
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.49
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-3-[ethyl(2-methylpropyl)amino]-2-(propylamino)propanamide
CID 63908718
2-cyclopropyl-3-[ethyl(2-methoxyethyl)amino]-2-(propylamino)propanamide
CID 63911750
2-cyclopropyl-3-[methyl(propan-2-yl)amino]-2-(propylamino)propanamide
CID 63907693
2-cyclopropyl-3-[ethyl(2-methylbutyl)amino]-2-(propan-2-ylamino)propanamide
CID 79480286
2-cyclopropyl-3-[2,2-dimethylpropyl(methyl)amino]-2-(propylamino)propanamide
CID 63909203
3-[cyclobutylmethyl(methyl)amino]-2-cyclopropyl-2-(propylamino)propanamide
CID 63925000
3-butan-2-ylsulfanyl-2-cyclopropyl-2-(propylamino)propanamide
CID 63916489
methyl 2-amino-2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]propanoate
CID 63910171
2-cyclopropyl-3-propan-2-ylsulfanyl-2-(propylamino)propanamide
CID 63921417
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propanamide
CID 63911092
methyl 2-cyclopropyl-3-[cyclopropylmethyl(ethyl)amino]-2-(propylamino)propanoate
CID 63956079
methyl 3-[butyl(ethyl)amino]-2-cyclopropyl-2-(propylamino)propanoate
CID 63906340

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide?
The IUPAC name of 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide (CID 63910757) is 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide.
What is the SMILES notation for 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide?
The canonical SMILES for 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide is CCCNC(CN(CC)CC(CC)CC)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide?
The InChIKey is UXNANEKKXTWPIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H35N3O/c1-5-11-19-17(16(18)21,15-9-10-15)13-20(8-4)12-14(6-2)7-3/h14-15,19H,5-13H2,1-4H3,(H2,18,21).
What are the key properties of 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide?
2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide has a molecular weight of 297.49 g/mol, XLogP of 2.38, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-[ethyl(2-ethylbutyl)amino]-2-(propylamino)propanamide is sourced from PubChem (CID 63910757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).