N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide

C16H28N2O2 — CID 114428560

IUPACN-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N(CC2CCOC2)C2CC2)C1
InChIInChI=1S/C16H28N2O2/c1-2-12-5-7-17-15(9-12)16(19)18(14-3-4-14)10-13-6-8-20-11-13/h12-15,17H,2-11H2,1H3
InChIKeyHQFGNGFVWZBVMJ-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.79
Rot. Bonds5

About N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide

N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide (PubChem CID 114428560) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
PubChem CID114428560
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC NameN-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)N(CC2CCOC2)C2CC2)C1
InChIInChI=1S/C16H28N2O2/c1-2-12-5-7-17-15(9-12)16(19)18(14-3-4-14)10-13-6-8-20-11-13/h12-15,17H,2-11H2,1H3
InChIKeyHQFGNGFVWZBVMJ-UHFFFAOYSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,4-diethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide
CID 114428566
4-ethyl-N-(oxolan-3-yl)piperidine-2-carboxamide
CID 114429328
N-cyclopropyl-N-(oxolan-3-ylmethyl)piperidine-4-carboxamide;hydrochloride
CID 119284851
4-ethyl-N-methyl-N-[(2-methylcyclopropyl)methyl]piperidine-2-carboxamide
CID 114429063
4-ethyl-N-methyl-N-(1-methylpiperidin-4-yl)piperidine-2-carboxamide
CID 114427893
N-butan-2-yl-N,4-diethylpiperidine-2-carboxamide
CID 114428039
1-cyclopropyl-3-ethyl-1-(oxolan-3-ylmethyl)urea
CID 71940583
1-cyclopropyl-3-ethyl-1-[[(3R)-oxolan-3-yl]methyl]urea
CID 97028885
N,N-dibutyl-4-ethylpiperidine-2-carboxamide
CID 114428005
2-[cyclopropylmethyl-(4-ethylpiperidine-2-carbonyl)amino]acetic acid
CID 114428663
N-[(4-ethylpiperidin-2-yl)methyl]-1-(oxolan-3-yl)methanamine
CID 114431077
3-amino-N-cyclopropyl-N-(oxolan-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119715175

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
The IUPAC name of N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide (CID 114428560) is N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
The canonical SMILES for N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide is CCC1CCNC(C(=O)N(CC2CCOC2)C2CC2)C1.
What is the InChIKey of N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
The InChIKey is HQFGNGFVWZBVMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-2-12-5-7-17-15(9-12)16(19)18(14-3-4-14)10-13-6-8-20-11-13/h12-15,17H,2-11H2,1H3.
What are the key properties of N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide?
N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide has a molecular weight of 280.41 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-ethyl-N-(oxolan-3-ylmethyl)piperidine-2-carboxamide is sourced from PubChem (CID 114428560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).