N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide

C15H27NO2 — CID 58376235

IUPACN-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide
SMILESCCCN(C(=O)C1CCCC(COC)C1)C1CC1
InChIInChI=1S/C15H27NO2/c1-3-9-16(14-7-8-14)15(17)13-6-4-5-12(10-13)11-18-2/h12-14H,3-11H2,1-2H3
InChIKeyOTZXHZOTPRAGHO-UHFFFAOYSA-N
MW253.39 g/mol
LogP2.84
Rot. Bonds6

About N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide

N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide (PubChem CID 58376235) has the molecular formula C15H27NO2 and a molecular weight of 253.39 g/mol. Its IUPAC name is N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide
PubChem CID58376235
Molecular FormulaC15H27NO2
Molecular Weight253.39 g/mol
Exact Mass253.20
IUPAC NameN-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide
SMILESCCCN(C(=O)C1CCCC(COC)C1)C1CC1
InChIInChI=1S/C15H27NO2/c1-3-9-16(14-7-8-14)15(17)13-6-4-5-12(10-13)11-18-2/h12-14H,3-11H2,1-2H3
InChIKeyOTZXHZOTPRAGHO-UHFFFAOYSA-N
XLogP2.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.39
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide?
The IUPAC name of N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide (CID 58376235) is N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide?
The canonical SMILES for N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide is CCCN(C(=O)C1CCCC(COC)C1)C1CC1.
What is the InChIKey of N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide?
The InChIKey is OTZXHZOTPRAGHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO2/c1-3-9-16(14-7-8-14)15(17)13-6-4-5-12(10-13)11-18-2/h12-14H,3-11H2,1-2H3.
What are the key properties of N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide?
N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide has a molecular weight of 253.39 g/mol, XLogP of 2.84, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-(methoxymethyl)-N-propylcyclohexane-1-carboxamide is sourced from PubChem (CID 58376235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).