1-(4-methoxycyclohexyl)-N-methylmethanamine

C9H19NO — CID 83863279

IUPAC1-(4-methoxycyclohexyl)-N-methylmethanamine
SMILESCNCC1CCC(OC)CC1
InChIInChI=1S/C9H19NO/c1-10-7-8-3-5-9(11-2)6-4-8/h8-10H,3-7H2,1-2H3
InChIKeyOKMIXHYBACMQTH-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.41
Rot. Bonds3

About 1-(4-methoxycyclohexyl)-N-methylmethanamine

1-(4-methoxycyclohexyl)-N-methylmethanamine (PubChem CID 83863279) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 1-(4-methoxycyclohexyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-methoxycyclohexyl)-N-methylmethanamine
PubChem CID83863279
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name1-(4-methoxycyclohexyl)-N-methylmethanamine
SMILESCNCC1CCC(OC)CC1
InChIInChI=1S/C9H19NO/c1-10-7-8-3-5-9(11-2)6-4-8/h8-10H,3-7H2,1-2H3
InChIKeyOKMIXHYBACMQTH-UHFFFAOYSA-N
XLogP1.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclohexanol, 4-(2-methylaminoethyl)-
CID 3048673
2-(4-Methoxycyclohexyl)ethylamine
CID 53434199
(4-Methoxycyclohexyl)methanamine
CID 55281686
(4-Ethoxycyclohexyl)methanamine
CID 57553441
trans-N-methyl-1-[4-(trifluoromethoxy)cyclohexyl]methanamine
CID 137346893
N-[[4-(trifluoromethoxy)cyclohexyl]methyl]ethanamine
CID 178674575
N-[[4-(trifluoromethoxy)cyclohexyl]methyl]propan-2-amine
CID 178674715
molecular hydrogen;N-[[4-(trifluoromethoxy)cyclohexyl]methyl]propan-2-amine
CID 178674722
1-[4-(difluoromethoxy)cyclohexyl]-N-methylmethanamine
CID 84720027
2-[4-(difluoromethoxy)cyclohexyl]-N-methylethanamine
CID 84722409
1-[4-methoxy-4-(trifluoromethyl)cyclohexyl]-N-methylmethanamine
CID 84735668
N-[[4-(difluoromethoxy)cyclohexyl]methyl]propan-2-amine
CID 178673782

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxycyclohexyl)-N-methylmethanamine?
The IUPAC name of 1-(4-methoxycyclohexyl)-N-methylmethanamine (CID 83863279) is 1-(4-methoxycyclohexyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-methoxycyclohexyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-methoxycyclohexyl)-N-methylmethanamine is CNCC1CCC(OC)CC1.
What is the InChIKey of 1-(4-methoxycyclohexyl)-N-methylmethanamine?
The InChIKey is OKMIXHYBACMQTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-10-7-8-3-5-9(11-2)6-4-8/h8-10H,3-7H2,1-2H3.
What are the key properties of 1-(4-methoxycyclohexyl)-N-methylmethanamine?
1-(4-methoxycyclohexyl)-N-methylmethanamine has a molecular weight of 157.26 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxycyclohexyl)-N-methylmethanamine is sourced from PubChem (CID 83863279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).