5,5-dimethyl-N-propylhex-1-en-2-amine

C11H23N — CID 126704253

IUPAC5,5-dimethyl-N-propylhex-1-en-2-amine
SMILESC=C(CCC(C)(C)C)NCCC
InChIInChI=1S/C11H23N/c1-6-9-12-10(2)7-8-11(3,4)5/h12H,2,6-9H2,1,3-5H3
InChIKeyGEMVODMKMTUGQK-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.33
Rot. Bonds5

About 5,5-dimethyl-N-propylhex-1-en-2-amine

5,5-dimethyl-N-propylhex-1-en-2-amine (PubChem CID 126704253) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 5,5-dimethyl-N-propylhex-1-en-2-amine.

Molecular Properties

Compound Name5,5-dimethyl-N-propylhex-1-en-2-amine
PubChem CID126704253
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name5,5-dimethyl-N-propylhex-1-en-2-amine
SMILESC=C(CCC(C)(C)C)NCCC
InChIInChI=1S/C11H23N/c1-6-9-12-10(2)7-8-11(3,4)5/h12H,2,6-9H2,1,3-5H3
InChIKeyGEMVODMKMTUGQK-UHFFFAOYSA-N
XLogP3.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 5,5-dimethyl-N-propylhex-1-en-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

2-Methylamino-6-methylhepten
CID 23616912
2-fluoro-3,3-dimethyl-N-(3-methylbut-1-en-2-yl)butan-1-amine
CID 153602081
N-[1-(1-fluorocyclobutyl)ethenyl]-2,2,4-trimethylpentan-3-amine
CID 171516200
N-but-1-en-2-yl-2-fluoro-3,3-dimethylpentan-1-amine
CID 174252636
N-(2-ethyl-4-fluorobutyl)-4,4-dimethylhex-1-en-2-amine
CID 153384724
N-butyl-3-methylpent-1-en-2-amine
CID 18717521
2-Tert-butyl-5-methylidenepyrrolidine
CID 57665262
N-ethyl-6-methylhepta-1,6-dien-2-amine
CID 57974006
N-(2,5-dimethylhex-1-en-3-yl)-4,4-dimethylhex-1-en-2-amine
CID 58185963
3,3-dimethyl-N-prop-1-en-2-ylbutan-1-amine
CID 58530871
N-butyl-3,3-dimethylpent-1-en-2-amine
CID 59096553
4-Tert-butyl-2-methylidene-1,3-dihydropyrrole
CID 59151472

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-N-propylhex-1-en-2-amine?
The IUPAC name of 5,5-dimethyl-N-propylhex-1-en-2-amine (CID 126704253) is 5,5-dimethyl-N-propylhex-1-en-2-amine.
What is the SMILES notation for 5,5-dimethyl-N-propylhex-1-en-2-amine?
The canonical SMILES for 5,5-dimethyl-N-propylhex-1-en-2-amine is C=C(CCC(C)(C)C)NCCC.
What is the InChIKey of 5,5-dimethyl-N-propylhex-1-en-2-amine?
The InChIKey is GEMVODMKMTUGQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-6-9-12-10(2)7-8-11(3,4)5/h12H,2,6-9H2,1,3-5H3.
What are the key properties of 5,5-dimethyl-N-propylhex-1-en-2-amine?
5,5-dimethyl-N-propylhex-1-en-2-amine has a molecular weight of 169.31 g/mol, XLogP of 3.33, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-N-propylhex-1-en-2-amine is sourced from PubChem (CID 126704253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).