3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide

C14H26N4O2 — CID 60866717

IUPAC3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
SMILESCNC(=O)CN1CCC(NC(=O)CCNC2CC2)CC1
InChIInChI=1S/C14H26N4O2/c1-15-14(20)10-18-8-5-12(6-9-18)17-13(19)4-7-16-11-2-3-11/h11-12,16H,2-10H2,1H3,(H,15,20)(H,17,19)
InChIKeyAQWUOQFQEKYQNW-UHFFFAOYSA-N
MW282.39 g/mol
LogP-0.54
Rot. Bonds7

About 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide

3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide (PubChem CID 60866717) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide.

Molecular Properties

Compound Name3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
PubChem CID60866717
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide
SMILESCNC(=O)CN1CCC(NC(=O)CCNC2CC2)CC1
InChIInChI=1S/C14H26N4O2/c1-15-14(20)10-18-8-5-12(6-9-18)17-13(19)4-7-16-11-2-3-11/h11-12,16H,2-10H2,1H3,(H,15,20)(H,17,19)
InChIKeyAQWUOQFQEKYQNW-UHFFFAOYSA-N
XLogP-0.54
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 5-0.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
The IUPAC name of 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide (CID 60866717) is 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide.
What is the SMILES notation for 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
The canonical SMILES for 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide is CNC(=O)CN1CCC(NC(=O)CCNC2CC2)CC1.
What is the InChIKey of 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
The InChIKey is AQWUOQFQEKYQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-15-14(20)10-18-8-5-12(6-9-18)17-13(19)4-7-16-11-2-3-11/h11-12,16H,2-10H2,1H3,(H,15,20)(H,17,19).
What are the key properties of 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide?
3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide has a molecular weight of 282.39 g/mol, XLogP of -0.54, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylamino)-N-[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]propanamide is sourced from PubChem (CID 60866717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).