2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide

C16H29N3O — CID 63909516

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide
SMILESCCC1CCCCN1CC(NC1CC1)(C(N)=O)C1CC1
InChIInChI=1S/C16H29N3O/c1-2-14-5-3-4-10-19(14)11-16(15(17)20,12-6-7-12)18-13-8-9-13/h12-14,18H,2-11H2,1H3,(H2,17,20)
InChIKeyNQTXEVWYQWCGEI-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.64
Rot. Bonds7

About 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide

2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide (PubChem CID 63909516) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide
PubChem CID63909516
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide
SMILESCCC1CCCCN1CC(NC1CC1)(C(N)=O)C1CC1
InChIInChI=1S/C16H29N3O/c1-2-14-5-3-4-10-19(14)11-16(15(17)20,12-6-7-12)18-13-8-9-13/h12-14,18H,2-11H2,1H3,(H2,17,20)
InChIKeyNQTXEVWYQWCGEI-UHFFFAOYSA-N
XLogP1.64
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide (CID 63909516) is 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide is CCC1CCCCN1CC(NC1CC1)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide?
The InChIKey is NQTXEVWYQWCGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-2-14-5-3-4-10-19(14)11-16(15(17)20,12-6-7-12)18-13-8-9-13/h12-14,18H,2-11H2,1H3,(H2,17,20).
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide?
2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide has a molecular weight of 279.43 g/mol, XLogP of 1.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-(2-ethylpiperidin-1-yl)propanamide is sourced from PubChem (CID 63909516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).