N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide

C17H30N2O2 — CID 120636117

IUPACN-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CC2C2CCCCC2)CCNCC1
InChIInChI=1S/C17H30N2O2/c1-21-12-17(7-9-18-10-8-17)16(20)19-15-11-14(15)13-5-3-2-4-6-13/h13-15,18H,2-12H2,1H3,(H,19,20)
InChIKeyKVFMPPQFCUABNU-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.09
Rot. Bonds5

About N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide

N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide (PubChem CID 120636117) has the molecular formula C17H30N2O2 and a molecular weight of 294.44 g/mol. Its IUPAC name is N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
PubChem CID120636117
Molecular FormulaC17H30N2O2
Molecular Weight294.44 g/mol
Exact Mass294.23
IUPAC NameN-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide
SMILESCOCC1(C(=O)NC2CC2C2CCCCC2)CCNCC1
InChIInChI=1S/C17H30N2O2/c1-21-12-17(7-9-18-10-8-17)16(20)19-15-11-14(15)13-5-3-2-4-6-13/h13-15,18H,2-12H2,1H3,(H,19,20)
InChIKeyKVFMPPQFCUABNU-UHFFFAOYSA-N
XLogP2.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The IUPAC name of N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide (CID 120636117) is N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide is COCC1(C(=O)NC2CC2C2CCCCC2)CCNCC1.
What is the InChIKey of N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide?
The InChIKey is KVFMPPQFCUABNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O2/c1-21-12-17(7-9-18-10-8-17)16(20)19-15-11-14(15)13-5-3-2-4-6-13/h13-15,18H,2-12H2,1H3,(H,19,20).
What are the key properties of N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide?
N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 2.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylcyclopropyl)-4-(methoxymethyl)piperidine-4-carboxamide is sourced from PubChem (CID 120636117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).