1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide

C15H28N2O — CID 164637911

IUPAC1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide
SMILESCCN1CCCCC1C(=O)N[C@H]1C[C@@H]1CC(C)C
InChIInChI=1S/C15H28N2O/c1-4-17-8-6-5-7-14(17)15(18)16-13-10-12(13)9-11(2)3/h11-14H,4-10H2,1-3H3,(H,16,18)/t12-,13-,14?/m0/s1
InChIKeyXDYHNYIKQYZVET-RFHHWMCGSA-N
MW252.40 g/mol
LogP2.41
Rot. Bonds5

About 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide

1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide (PubChem CID 164637911) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide
PubChem CID164637911
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide
SMILESCCN1CCCCC1C(=O)N[C@H]1C[C@@H]1CC(C)C
InChIInChI=1S/C15H28N2O/c1-4-17-8-6-5-7-14(17)15(18)16-13-10-12(13)9-11(2)3/h11-14H,4-10H2,1-3H3,(H,16,18)/t12-,13-,14?/m0/s1
InChIKeyXDYHNYIKQYZVET-RFHHWMCGSA-N
XLogP2.41
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide?
The IUPAC name of 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide (CID 164637911) is 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide?
The canonical SMILES for 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide is CCN1CCCCC1C(=O)N[C@H]1C[C@@H]1CC(C)C.
What is the InChIKey of 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide?
The InChIKey is XDYHNYIKQYZVET-RFHHWMCGSA-N. The full InChI is InChI=1S/C15H28N2O/c1-4-17-8-6-5-7-14(17)15(18)16-13-10-12(13)9-11(2)3/h11-14H,4-10H2,1-3H3,(H,16,18)/t12-,13-,14?/m0/s1.
What are the key properties of 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide?
1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide has a molecular weight of 252.40 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[(1S,2S)-2-(2-methylpropyl)cyclopropyl]piperidine-2-carboxamide is sourced from PubChem (CID 164637911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).