(Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine

C11H23N — CID 89382134

IUPAC(Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine
SMILESCC/C=C\CCNCC(C)(C)C
InChIInChI=1S/C11H23N/c1-5-6-7-8-9-12-10-11(2,3)4/h6-7,12H,5,8-10H2,1-4H3/b7-6-
InChIKeyYLDHDTJKUXTNMU-SREVYHEPSA-N
MW169.31 g/mol
LogP2.98
Rot. Bonds5

About (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine

(Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine (PubChem CID 89382134) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine.

Molecular Properties

Compound Name(Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine
PubChem CID89382134
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name(Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine
SMILESCC/C=C\CCNCC(C)(C)C
InChIInChI=1S/C11H23N/c1-5-6-7-8-9-12-10-11(2,3)4/h6-7,12H,5,8-10H2,1-4H3/b7-6-
InChIKeyYLDHDTJKUXTNMU-SREVYHEPSA-N
XLogP2.98
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 ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-tert-butylhex-3-en-1-amine
CID 112734327
2,2-dimethyl-N-propylpropan-1-amine
CID 551573
N-ethyl-N'-hex-3-enylpentane-1,5-diamine
CID 123144490
(3Z,7Z,11Z)-tetradeca-3,7,11-triene
CID 123167975
(7Z)-deca-3,7-diene
CID 173009236
N'-(2,2-dimethylpropyl)ethane-1,2-diamine
CID 61168060
N'-(2,2-dimethylpropyl)-N-methylethane-1,2-diamine
CID 61168461
(Z)-N-propylhept-4-en-1-amine
CID 142957499
(2E)-nona-2,6-dienal
CID 6992048
2-[[(E)-hex-3-enyl]amino]propanenitrile
CID 101282802
(3Z,6Z,9Z,12Z,15Z,18Z)-23,23-dimethyltetracosa-3,6,9,12,15,18-hexaene
CID 140672812
N-methylhept-4-en-1-amine
CID 122695118

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine?
The IUPAC name of (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine (CID 89382134) is (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine.
What is the SMILES notation for (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine?
The canonical SMILES for (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine is CC/C=C\CCNCC(C)(C)C.
What is the InChIKey of (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine?
The InChIKey is YLDHDTJKUXTNMU-SREVYHEPSA-N. The full InChI is InChI=1S/C11H23N/c1-5-6-7-8-9-12-10-11(2,3)4/h6-7,12H,5,8-10H2,1-4H3/b7-6-.
What are the key properties of (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine?
(Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine has a molecular weight of 169.31 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(2,2-dimethylpropyl)hex-3-en-1-amine is sourced from PubChem (CID 89382134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).