N-(adamantane-1-carbonyl)piperidine-1-carboxamide

C17H26N2O2 — CID 2830218

IUPACN-(adamantane-1-carbonyl)piperidine-1-carboxamide
SMILESO=C(NC(=O)C12CC3CC(CC(C3)C1)C2)N1CCCCC1
InChIInChI=1S/C17H26N2O2/c20-15(18-16(21)19-4-2-1-3-5-19)17-9-12-6-13(10-17)8-14(7-12)11-17/h12-14H,1-11H2,(H,18,20,21)
InChIKeyAJOCVCIMFMPDDZ-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.92
Rot. Bonds1

About N-(adamantane-1-carbonyl)piperidine-1-carboxamide

N-(adamantane-1-carbonyl)piperidine-1-carboxamide (PubChem CID 2830218) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(adamantane-1-carbonyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(adamantane-1-carbonyl)piperidine-1-carboxamide
PubChem CID2830218
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(adamantane-1-carbonyl)piperidine-1-carboxamide
SMILESO=C(NC(=O)C12CC3CC(CC(C3)C1)C2)N1CCCCC1
InChIInChI=1S/C17H26N2O2/c20-15(18-16(21)19-4-2-1-3-5-19)17-9-12-6-13(10-17)8-14(7-12)11-17/h12-14H,1-11H2,(H,18,20,21)
InChIKeyAJOCVCIMFMPDDZ-UHFFFAOYSA-N
XLogP2.92
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(adamantane-1-carbonyl)piperidine-1-carboxamide?
The IUPAC name of N-(adamantane-1-carbonyl)piperidine-1-carboxamide (CID 2830218) is N-(adamantane-1-carbonyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(adamantane-1-carbonyl)piperidine-1-carboxamide?
The canonical SMILES for N-(adamantane-1-carbonyl)piperidine-1-carboxamide is O=C(NC(=O)C12CC3CC(CC(C3)C1)C2)N1CCCCC1.
What is the InChIKey of N-(adamantane-1-carbonyl)piperidine-1-carboxamide?
The InChIKey is AJOCVCIMFMPDDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c20-15(18-16(21)19-4-2-1-3-5-19)17-9-12-6-13(10-17)8-14(7-12)11-17/h12-14H,1-11H2,(H,18,20,21).
What are the key properties of N-(adamantane-1-carbonyl)piperidine-1-carboxamide?
N-(adamantane-1-carbonyl)piperidine-1-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.92, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(adamantane-1-carbonyl)piperidine-1-carboxamide is sourced from PubChem (CID 2830218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).