N,4-diethyl-1-propan-2-yloxyhexan-2-amine

C13H29NO — CID 105176889

IUPACN,4-diethyl-1-propan-2-yloxyhexan-2-amine
SMILESCCNC(COC(C)C)CC(CC)CC
InChIInChI=1S/C13H29NO/c1-6-12(7-2)9-13(14-8-3)10-15-11(4)5/h11-14H,6-10H2,1-5H3
InChIKeyGZNVREXIYMWJBO-UHFFFAOYSA-N
MW215.38 g/mol
LogP3.22
Rot. Bonds9

About N,4-diethyl-1-propan-2-yloxyhexan-2-amine

N,4-diethyl-1-propan-2-yloxyhexan-2-amine (PubChem CID 105176889) has the molecular formula C13H29NO and a molecular weight of 215.38 g/mol. Its IUPAC name is N,4-diethyl-1-propan-2-yloxyhexan-2-amine.

Molecular Properties

Compound NameN,4-diethyl-1-propan-2-yloxyhexan-2-amine
PubChem CID105176889
Molecular FormulaC13H29NO
Molecular Weight215.38 g/mol
Exact Mass215.22
IUPAC NameN,4-diethyl-1-propan-2-yloxyhexan-2-amine
SMILESCCNC(COC(C)C)CC(CC)CC
InChIInChI=1S/C13H29NO/c1-6-12(7-2)9-13(14-8-3)10-15-11(4)5/h11-14H,6-10H2,1-5H3
InChIKeyGZNVREXIYMWJBO-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.38
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N,4-diethyl-1-propan-2-yloxyhexan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-4-methyl-1-propan-2-yloxypentan-2-amine
CID 79574126
N,3-diethyl-7-methylnonan-5-amine
CID 105028147
N-ethyl-4-(2-methoxyethoxy)-1-propan-2-yloxybutan-2-amine
CID 102928377
N-ethyl-1-(furan-3-yl)-3-propan-2-yloxypropan-2-amine
CID 105177781
N-ethyl-1-(2-propan-2-yloxyethoxy)pentan-2-amine
CID 62042339
N-ethyl-1-(4-iodophenyl)-3-propan-2-yloxypropan-2-amine
CID 105152021
1-ethoxy-4-ethyl-N-propylhexan-2-amine
CID 82922255
1-tert-butylsulfanyl-N,4-diethylhexan-2-amine
CID 82922711
N-ethyl-1-propan-2-yloxy-3-thiophen-2-ylpropan-2-amine
CID 79574610
N-ethyl-1-methoxy-3-(1-methoxypropan-2-yloxy)propan-2-amine
CID 107506869
N,4-diethyl-1-(1-methoxycyclobutyl)hexan-2-amine
CID 103559751
1-(5-chlorothiophen-2-yl)-N-ethyl-3-propan-2-yloxypropan-2-amine
CID 105135378

Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-1-propan-2-yloxyhexan-2-amine?
The IUPAC name of N,4-diethyl-1-propan-2-yloxyhexan-2-amine (CID 105176889) is N,4-diethyl-1-propan-2-yloxyhexan-2-amine.
What is the SMILES notation for N,4-diethyl-1-propan-2-yloxyhexan-2-amine?
The canonical SMILES for N,4-diethyl-1-propan-2-yloxyhexan-2-amine is CCNC(COC(C)C)CC(CC)CC.
What is the InChIKey of N,4-diethyl-1-propan-2-yloxyhexan-2-amine?
The InChIKey is GZNVREXIYMWJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO/c1-6-12(7-2)9-13(14-8-3)10-15-11(4)5/h11-14H,6-10H2,1-5H3.
What are the key properties of N,4-diethyl-1-propan-2-yloxyhexan-2-amine?
N,4-diethyl-1-propan-2-yloxyhexan-2-amine has a molecular weight of 215.38 g/mol, XLogP of 3.22, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-1-propan-2-yloxyhexan-2-amine is sourced from PubChem (CID 105176889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).