4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide

C15H27N3O2 — CID 75383307

IUPAC4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide
SMILESCCOC1CC(NC2CCN(C(N)=O)CC2)C12CCC2
InChIInChI=1S/C15H27N3O2/c1-2-20-13-10-12(15(13)6-3-7-15)17-11-4-8-18(9-5-11)14(16)19/h11-13,17H,2-10H2,1H3,(H2,16,19)
InChIKeySWZGEPMRPCSIBZ-UHFFFAOYSA-N
MW281.40 g/mol
LogP1.47
Rot. Bonds4

About 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide

4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide (PubChem CID 75383307) has the molecular formula C15H27N3O2 and a molecular weight of 281.40 g/mol. Its IUPAC name is 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide
PubChem CID75383307
Molecular FormulaC15H27N3O2
Molecular Weight281.40 g/mol
Exact Mass281.21
IUPAC Name4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide
SMILESCCOC1CC(NC2CCN(C(N)=O)CC2)C12CCC2
InChIInChI=1S/C15H27N3O2/c1-2-20-13-10-12(15(13)6-3-7-15)17-11-4-8-18(9-5-11)14(16)19/h11-13,17H,2-10H2,1H3,(H2,16,19)
InChIKeySWZGEPMRPCSIBZ-UHFFFAOYSA-N
XLogP1.47
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide?
The IUPAC name of 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide (CID 75383307) is 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide.
What is the SMILES notation for 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide?
The canonical SMILES for 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide is CCOC1CC(NC2CCN(C(N)=O)CC2)C12CCC2.
What is the InChIKey of 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide?
The InChIKey is SWZGEPMRPCSIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O2/c1-2-20-13-10-12(15(13)6-3-7-15)17-11-4-8-18(9-5-11)14(16)19/h11-13,17H,2-10H2,1H3,(H2,16,19).
What are the key properties of 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide?
4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 1.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 75383307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).