N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide

C14H27N3O — CID 114507912

IUPACN-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
SMILESCCC1CN(C(C)C(=O)NC2CC2)CCC1NC
InChIInChI=1S/C14H27N3O/c1-4-11-9-17(8-7-13(11)15-3)10(2)14(18)16-12-5-6-12/h10-13,15H,4-9H2,1-3H3,(H,16,18)
InChIKeyOHSTWWXAQFSOHJ-UHFFFAOYSA-N
MW253.39 g/mol
LogP0.97
Rot. Bonds5

About N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide

N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide (PubChem CID 114507912) has the molecular formula C14H27N3O and a molecular weight of 253.39 g/mol. Its IUPAC name is N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
PubChem CID114507912
Molecular FormulaC14H27N3O
Molecular Weight253.39 g/mol
Exact Mass253.22
IUPAC NameN-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
SMILESCCC1CN(C(C)C(=O)NC2CC2)CCC1NC
InChIInChI=1S/C14H27N3O/c1-4-11-9-17(8-7-13(11)15-3)10(2)14(18)16-12-5-6-12/h10-13,15H,4-9H2,1-3H3,(H,16,18)
InChIKeyOHSTWWXAQFSOHJ-UHFFFAOYSA-N
XLogP0.97
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide (CID 114507912) is N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide is CCC1CN(C(C)C(=O)NC2CC2)CCC1NC.
What is the InChIKey of N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
The InChIKey is OHSTWWXAQFSOHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O/c1-4-11-9-17(8-7-13(11)15-3)10(2)14(18)16-12-5-6-12/h10-13,15H,4-9H2,1-3H3,(H,16,18).
What are the key properties of N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide has a molecular weight of 253.39 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide is sourced from PubChem (CID 114507912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).