4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine

C16H32N2O — CID 114763353

IUPAC4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(N2CCC(COC)CC2)CC1
InChIInChI=1S/C16H32N2O/c1-3-10-17-15-4-6-16(7-5-15)18-11-8-14(9-12-18)13-19-2/h14-17H,3-13H2,1-2H3
InChIKeyAAVBIQHPRNUFIW-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.66
Rot. Bonds6

About 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine

4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine (PubChem CID 114763353) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine
PubChem CID114763353
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(N2CCC(COC)CC2)CC1
InChIInChI=1S/C16H32N2O/c1-3-10-17-15-4-6-16(7-5-15)18-11-8-14(9-12-18)13-19-2/h14-17H,3-13H2,1-2H3
InChIKeyAAVBIQHPRNUFIW-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-ethylazepan-1-yl)-N-propylcyclohexan-1-amine
CID 114763370
4-[4-(methoxymethyl)piperidin-1-yl]cyclohexan-1-amine
CID 63973090
1-cyclobutyl-4-(methoxymethyl)piperidine
CID 131107152
4-(4-propan-2-ylazepan-1-yl)-N-propylcyclohexan-1-amine
CID 114763375
2-[4-(methoxymethyl)piperidin-1-yl]-N-propylcycloheptan-1-amine
CID 63972305
1-cyclopentyl-4-(methoxymethyl)piperidine;ethane
CID 156885673
N-[(1-cyclopropylpiperidin-4-yl)methyl]cyclopropanamine
CID 83907747
4-(4,4-diethylpiperidin-1-yl)-N-propylcyclohexan-1-amine
CID 114763283
1-[4-(methoxymethyl)cyclohexyl]piperidin-4-amine
CID 71054955
N-ethyl-4-(4-propylpiperidin-1-yl)cyclohexan-1-amine
CID 114763207
1-(oxan-4-yl)-N-propylpiperidin-4-amine
CID 43610262
1-(1-iodopiperidin-4-yl)-N-propylpiperidin-4-amine
CID 166946144

Frequently Asked Questions

What is the IUPAC name of 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine?
The IUPAC name of 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine (CID 114763353) is 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine.
What is the SMILES notation for 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine?
The canonical SMILES for 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine is CCCNC1CCC(N2CCC(COC)CC2)CC1.
What is the InChIKey of 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine?
The InChIKey is AAVBIQHPRNUFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-3-10-17-15-4-6-16(7-5-15)18-11-8-14(9-12-18)13-19-2/h14-17H,3-13H2,1-2H3.
What are the key properties of 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine?
4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine has a molecular weight of 268.44 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(methoxymethyl)piperidin-1-yl]-N-propylcyclohexan-1-amine is sourced from PubChem (CID 114763353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).