[3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine

C16H30N2O — CID 64624830

IUPAC[3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine
SMILESCC1(C)COCCN1C1(CN)CCCC(C2CC2)C1
InChIInChI=1S/C16H30N2O/c1-15(2)12-19-9-8-18(15)16(11-17)7-3-4-14(10-16)13-5-6-13/h13-14H,3-12,17H2,1-2H3
InChIKeyHSIPNQWOZYPVNY-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.39
Rot. Bonds3

About [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine

[3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine (PubChem CID 64624830) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine
PubChem CID64624830
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name[3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine
SMILESCC1(C)COCCN1C1(CN)CCCC(C2CC2)C1
InChIInChI=1S/C16H30N2O/c1-15(2)12-19-9-8-18(15)16(11-17)7-3-4-14(10-16)13-5-6-13/h13-14H,3-12,17H2,1-2H3
InChIKeyHSIPNQWOZYPVNY-UHFFFAOYSA-N
XLogP2.39
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(3,3-dimethylmorpholin-4-yl)-3-propan-2-ylcyclobutyl]methanamine
CID 103562702
[1-(3,3-dimethylmorpholin-4-yl)-2,3-dimethylcyclohexyl]methanamine
CID 64761578
[3-cyclopropyl-1-(3,4-dimethylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 79188405
[1-(8-azaspiro[4.5]decan-8-yl)-3-cyclopropylcyclohexyl]methanamine
CID 64625031
[1-(3,3-dimethylmorpholin-4-yl)-2,2-dimethylcyclopentyl]methanamine
CID 79857901
[1-(3,3-dimethylmorpholin-4-yl)-2,2-dimethylcyclohexyl]methanamine
CID 79847900
[3-cyclopropyl-1-(3-ethylpiperidin-1-yl)cyclohexyl]methanamine
CID 64625427
[3-cyclopropyl-1-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)cyclohexyl]methanamine
CID 79166206
[3-cyclopropyl-1-(2-ethyl-5-methylpyrrolidin-1-yl)cyclohexyl]methanamine
CID 83227967
N-[1-(aminomethyl)-3-cyclopropylcyclohexyl]morpholin-4-amine
CID 83011983
[3-(azetidin-1-yl)oxolan-3-yl]methanamine
CID 84763755
[1-(3-methylmorpholin-4-yl)cyclobutyl]methanamine
CID 79521252

Frequently Asked Questions

What is the IUPAC name of [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
The IUPAC name of [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine (CID 64624830) is [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine.
What is the SMILES notation for [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
The canonical SMILES for [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine is CC1(C)COCCN1C1(CN)CCCC(C2CC2)C1.
What is the InChIKey of [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
The InChIKey is HSIPNQWOZYPVNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-15(2)12-19-9-8-18(15)16(11-17)7-3-4-14(10-16)13-5-6-13/h13-14H,3-12,17H2,1-2H3.
What are the key properties of [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine?
[3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine has a molecular weight of 266.43 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-cyclopropyl-1-(3,3-dimethylmorpholin-4-yl)cyclohexyl]methanamine is sourced from PubChem (CID 64624830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).