N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine

C19H37NO — CID 116770366

IUPACN-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine
SMILESCCNC(C1CCC(CC)CC1)C1(OC)CCCCCC1
InChIInChI=1S/C19H37NO/c1-4-16-10-12-17(13-11-16)18(20-5-2)19(21-3)14-8-6-7-9-15-19/h16-18,20H,4-15H2,1-3H3
InChIKeyFMAYWHUEXYXDQI-UHFFFAOYSA-N
MW295.51 g/mol
LogP4.92
Rot. Bonds6

About N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine

N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine (PubChem CID 116770366) has the molecular formula C19H37NO and a molecular weight of 295.51 g/mol. Its IUPAC name is N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine
PubChem CID116770366
Molecular FormulaC19H37NO
Molecular Weight295.51 g/mol
Exact Mass295.29
IUPAC NameN-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine
SMILESCCNC(C1CCC(CC)CC1)C1(OC)CCCCCC1
InChIInChI=1S/C19H37NO/c1-4-16-10-12-17(13-11-16)18(20-5-2)19(21-3)14-8-6-7-9-15-19/h16-18,20H,4-15H2,1-3H3
InChIKeyFMAYWHUEXYXDQI-UHFFFAOYSA-N
XLogP4.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.51
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylcyclohexyl)-1-(1-methoxycycloheptyl)-N-methylmethanamine
CID 116770174
N-[cyclopropyl-(1-methoxy-4,4-dimethylcyclohexyl)methyl]ethanamine
CID 116769652
N-[cyclopropyl-(1-methoxycyclopentyl)methyl]propan-1-amine
CID 104611352
N-[cyclohexyl-(1-methoxycycloheptyl)methyl]propan-1-amine
CID 116770430
N-[(3-ethylcyclohexyl)-(1-methoxy-4-methylcyclohexyl)methyl]ethanamine
CID 116766696
[cyclopropyl-(1-methoxycycloheptyl)methyl]hydrazine
CID 105278128
1-(4-ethylcyclohexyl)-1-(1-methoxy-3-methylcyclohexyl)-N-methylmethanamine
CID 116767881
[2-cyclopropyl-1-(1-methoxycyclohexyl)ethyl]hydrazine
CID 105275891
N-ethyl-1-(1-methoxycycloheptyl)-3-methylidenepentan-1-amine
CID 116770367
[(1-methoxycycloheptyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105278264
N-[(3,4-dimethylcyclohexyl)-(1-ethoxycyclohexyl)methyl]ethanamine
CID 116764131
N-[cycloheptyl-(4-ethylcyclohexyl)methyl]ethanamine
CID 65399653

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine?
The IUPAC name of N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine (CID 116770366) is N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine.
What is the SMILES notation for N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine?
The canonical SMILES for N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine is CCNC(C1CCC(CC)CC1)C1(OC)CCCCCC1.
What is the InChIKey of N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine?
The InChIKey is FMAYWHUEXYXDQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H37NO/c1-4-16-10-12-17(13-11-16)18(20-5-2)19(21-3)14-8-6-7-9-15-19/h16-18,20H,4-15H2,1-3H3.
What are the key properties of N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine?
N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine has a molecular weight of 295.51 g/mol, XLogP of 4.92, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylcyclohexyl)-(1-methoxycycloheptyl)methyl]ethanamine is sourced from PubChem (CID 116770366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).