N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine

C14H29N — CID 18714542

IUPACN-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine
SMILESCCNC(C)C1CC(C)CCC1C(C)C
InChIInChI=1S/C14H29N/c1-6-15-12(5)14-9-11(4)7-8-13(14)10(2)3/h10-15H,6-9H2,1-5H3
InChIKeyBMOGPVPEFNMQPS-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.69
Rot. Bonds4

About N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine

N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine (PubChem CID 18714542) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine
PubChem CID18714542
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine
SMILESCCNC(C)C1CC(C)CCC1C(C)C
InChIInChI=1S/C14H29N/c1-6-15-12(5)14-9-11(4)7-8-13(14)10(2)3/h10-15H,6-9H2,1-5H3
InChIKeyBMOGPVPEFNMQPS-UHFFFAOYSA-N
XLogP3.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine?
The IUPAC name of N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine (CID 18714542) is N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine?
The canonical SMILES for N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine is CCNC(C)C1CC(C)CCC1C(C)C.
What is the InChIKey of N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine?
The InChIKey is BMOGPVPEFNMQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-6-15-12(5)14-9-11(4)7-8-13(14)10(2)3/h10-15H,6-9H2,1-5H3.
What are the key properties of N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine?
N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine has a molecular weight of 211.39 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(5-methyl-2-propan-2-ylcyclohexyl)ethanamine is sourced from PubChem (CID 18714542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).