(Z)-6,6-dimethylhept-1-en-1-amine

C9H19N — CID 89037206

IUPAC(Z)-6,6-dimethylhept-1-en-1-amine
SMILESCC(C)(C)CCC/C=C\N
InChIInChI=1S/C9H19N/c1-9(2,3)7-5-4-6-8-10/h6,8H,4-5,7,10H2,1-3H3/b8-6-
InChIKeyPPPNLLRFVBIVIQ-VURMDHGXSA-N
MW141.26 g/mol
LogP2.68
Rot. Bonds3

About (Z)-6,6-dimethylhept-1-en-1-amine

(Z)-6,6-dimethylhept-1-en-1-amine (PubChem CID 89037206) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is (Z)-6,6-dimethylhept-1-en-1-amine.

Molecular Properties

Compound Name(Z)-6,6-dimethylhept-1-en-1-amine
PubChem CID89037206
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC Name(Z)-6,6-dimethylhept-1-en-1-amine
SMILESCC(C)(C)CCC/C=C\N
InChIInChI=1S/C9H19N/c1-9(2,3)7-5-4-6-8-10/h6,8H,4-5,7,10H2,1-3H3/b8-6-
InChIKeyPPPNLLRFVBIVIQ-VURMDHGXSA-N
XLogP2.68
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-5,5-dimethylhex-1-en-1-amine
CID 166660755
(E)-10,10-dimethylundec-5-ene
CID 142794628
(4Z,7Z)-12,12-dimethyltrideca-4,7-diene
CID 176739727
(3Z,6Z,9Z,12Z,15Z,18Z)-23,23-dimethyltetracosa-3,6,9,12,15,18-hexaene
CID 140672812
hept-1-en-1-amine
CID 73447107
(Z)-2,2-dimethylnonadec-7-ene
CID 176613705
(E)-dec-1-en-1-amine
CID 21420709
4,4-dimethylpentan-1-amine
CID 14454757
(2E,4E)-10,10-dimethylundeca-2,4-diene
CID 166042308
1-(11,11-dimethyldodec-1-enoxy)-11,11-dimethyldodec-1-ene
CID 139610664
(E)-2,11-dimethyldodec-6-ene-2,11-diol
CID 87994195
(E)-dec-1-ene-1,10-diamine
CID 87528471

Frequently Asked Questions

What is the IUPAC name of (Z)-6,6-dimethylhept-1-en-1-amine?
The IUPAC name of (Z)-6,6-dimethylhept-1-en-1-amine (CID 89037206) is (Z)-6,6-dimethylhept-1-en-1-amine.
What is the SMILES notation for (Z)-6,6-dimethylhept-1-en-1-amine?
The canonical SMILES for (Z)-6,6-dimethylhept-1-en-1-amine is CC(C)(C)CCC/C=C\N.
What is the InChIKey of (Z)-6,6-dimethylhept-1-en-1-amine?
The InChIKey is PPPNLLRFVBIVIQ-VURMDHGXSA-N. The full InChI is InChI=1S/C9H19N/c1-9(2,3)7-5-4-6-8-10/h6,8H,4-5,7,10H2,1-3H3/b8-6-.
What are the key properties of (Z)-6,6-dimethylhept-1-en-1-amine?
(Z)-6,6-dimethylhept-1-en-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6,6-dimethylhept-1-en-1-amine is sourced from PubChem (CID 89037206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).