6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide

C15H27NO — CID 12947851

IUPAC6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide
SMILESCCC1CCCC=C1C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C15H27NO/c1-6-13-9-7-8-10-14(13)15(17)16(11(2)3)12(4)5/h10-13H,6-9H2,1-5H3
InChIKeyFBMGWYWSPAKUDP-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.77
Rot. Bonds4

About 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide

6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide (PubChem CID 12947851) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide.

Molecular Properties

Compound Name6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide
PubChem CID12947851
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide
SMILESCCC1CCCC=C1C(=O)N(C(C)C)C(C)C
InChIInChI=1S/C15H27NO/c1-6-13-9-7-8-10-14(13)15(17)16(11(2)3)12(4)5/h10-13H,6-9H2,1-5H3
InChIKeyFBMGWYWSPAKUDP-UHFFFAOYSA-N
XLogP3.77
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide?
The IUPAC name of 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide (CID 12947851) is 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide.
What is the SMILES notation for 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide?
The canonical SMILES for 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide is CCC1CCCC=C1C(=O)N(C(C)C)C(C)C.
What is the InChIKey of 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide?
The InChIKey is FBMGWYWSPAKUDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-6-13-9-7-8-10-14(13)15(17)16(11(2)3)12(4)5/h10-13H,6-9H2,1-5H3.
What are the key properties of 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide?
6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide has a molecular weight of 237.39 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N,N-di(propan-2-yl)cyclohexene-1-carboxamide is sourced from PubChem (CID 12947851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).