N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine

C14H29N — CID 66862979

IUPACN-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine
SMILESCCNC1(C(C)C)CCCCC1C(C)C
InChIInChI=1S/C14H29N/c1-6-15-14(12(4)5)10-8-7-9-13(14)11(2)3/h11-13,15H,6-10H2,1-5H3
InChIKeyIAWPFWPQBNQKLM-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.84
Rot. Bonds4

About N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine

N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine (PubChem CID 66862979) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine
PubChem CID66862979
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine
SMILESCCNC1(C(C)C)CCCCC1C(C)C
InChIInChI=1S/C14H29N/c1-6-15-14(12(4)5)10-8-7-9-13(14)11(2)3/h11-13,15H,6-10H2,1-5H3
InChIKeyIAWPFWPQBNQKLM-UHFFFAOYSA-N
XLogP3.84
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 ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine?
The IUPAC name of N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine (CID 66862979) is N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine?
The canonical SMILES for N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine is CCNC1(C(C)C)CCCCC1C(C)C.
What is the InChIKey of N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine?
The InChIKey is IAWPFWPQBNQKLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-6-15-14(12(4)5)10-8-7-9-13(14)11(2)3/h11-13,15H,6-10H2,1-5H3.
What are the key properties of N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine?
N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine has a molecular weight of 211.39 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,2-di(propan-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 66862979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).