N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide

C16H29N3O2 — CID 63128379

IUPACN-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(CC)CCNCC2)CC1
InChIInChI=1S/C16H29N3O2/c1-3-14(20)18-13-5-11-19(12-6-13)15(21)16(4-2)7-9-17-10-8-16/h13,17H,3-12H2,1-2H3,(H,18,20)
InChIKeyBVZVXISBIVNMHQ-UHFFFAOYSA-N
MW295.43 g/mol
LogP1.28
Rot. Bonds4

About N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide

N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide (PubChem CID 63128379) has the molecular formula C16H29N3O2 and a molecular weight of 295.43 g/mol. Its IUPAC name is N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
PubChem CID63128379
Molecular FormulaC16H29N3O2
Molecular Weight295.43 g/mol
Exact Mass295.23
IUPAC NameN-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide
SMILESCCC(=O)NC1CCN(C(=O)C2(CC)CCNCC2)CC1
InChIInChI=1S/C16H29N3O2/c1-3-14(20)18-13-5-11-19(12-6-13)15(21)16(4-2)7-9-17-10-8-16/h13,17H,3-12H2,1-2H3,(H,18,20)
InChIKeyBVZVXISBIVNMHQ-UHFFFAOYSA-N
XLogP1.28
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
The IUPAC name of N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide (CID 63128379) is N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide.
What is the SMILES notation for N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
The canonical SMILES for N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide is CCC(=O)NC1CCN(C(=O)C2(CC)CCNCC2)CC1.
What is the InChIKey of N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
The InChIKey is BVZVXISBIVNMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O2/c1-3-14(20)18-13-5-11-19(12-6-13)15(21)16(4-2)7-9-17-10-8-16/h13,17H,3-12H2,1-2H3,(H,18,20).
What are the key properties of N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide?
N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide has a molecular weight of 295.43 g/mol, XLogP of 1.28, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylpiperidine-4-carbonyl)piperidin-4-yl]propanamide is sourced from PubChem (CID 63128379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).