(Z)-N,4,5-trimethylhept-2-en-1-amine

C10H21N — CID 155275180

IUPAC(Z)-N,4,5-trimethylhept-2-en-1-amine
SMILESCCC(C)C(C)/C=C\CNC
InChIInChI=1S/C10H21N/c1-5-9(2)10(3)7-6-8-11-4/h6-7,9-11H,5,8H2,1-4H3/b7-6-
InChIKeySAWGAEUTXOEYSO-SREVYHEPSA-N
MW155.28 g/mol
LogP2.44
Rot. Bonds5

About (Z)-N,4,5-trimethylhept-2-en-1-amine

(Z)-N,4,5-trimethylhept-2-en-1-amine (PubChem CID 155275180) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (Z)-N,4,5-trimethylhept-2-en-1-amine.

Molecular Properties

Compound Name(Z)-N,4,5-trimethylhept-2-en-1-amine
PubChem CID155275180
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(Z)-N,4,5-trimethylhept-2-en-1-amine
SMILESCCC(C)C(C)/C=C\CNC
InChIInChI=1S/C10H21N/c1-5-9(2)10(3)7-6-8-11-4/h6-7,9-11H,5,8H2,1-4H3/b7-6-
InChIKeySAWGAEUTXOEYSO-SREVYHEPSA-N
XLogP2.44
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(E)-N,4-dimethylhept-2-en-1-amine
CID 131243211
(E)-5,6-dimethyloct-3-enoic acid
CID 155168954
(2E,5E,7R,8S)-3,7,8-trimethyldeca-2,5-dien-1-ol
CID 59516406
2,3-dimethyldec-5-ene;3,4-dimethyldec-5-ene
CID 173464801
(Z)-N-methyl-N'-propan-2-ylbut-2-ene-1,4-diamine
CID 171552385
4-methyl-N-propan-2-ylhex-2-en-1-amine
CID 115278158
(3S)-2-ethyl-N,3-dimethylpentan-1-amine
CID 163536067
3-ethyl-N,4-dimethylhexan-2-amine
CID 163950897
6,7,9-trimethyldec-4-ene
CID 123201610
N-(2-methoxyethyl)-4-methylhex-2-en-1-amine
CID 115278166
(3R,4R)-3,4-dimethylhexane;methane
CID 159261482
ethane;N,3,4-trimethylhexan-1-amine
CID 145138668

Frequently Asked Questions

What is the IUPAC name of (Z)-N,4,5-trimethylhept-2-en-1-amine?
The IUPAC name of (Z)-N,4,5-trimethylhept-2-en-1-amine (CID 155275180) is (Z)-N,4,5-trimethylhept-2-en-1-amine.
What is the SMILES notation for (Z)-N,4,5-trimethylhept-2-en-1-amine?
The canonical SMILES for (Z)-N,4,5-trimethylhept-2-en-1-amine is CCC(C)C(C)/C=C\CNC.
What is the InChIKey of (Z)-N,4,5-trimethylhept-2-en-1-amine?
The InChIKey is SAWGAEUTXOEYSO-SREVYHEPSA-N. The full InChI is InChI=1S/C10H21N/c1-5-9(2)10(3)7-6-8-11-4/h6-7,9-11H,5,8H2,1-4H3/b7-6-.
What are the key properties of (Z)-N,4,5-trimethylhept-2-en-1-amine?
(Z)-N,4,5-trimethylhept-2-en-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,4,5-trimethylhept-2-en-1-amine is sourced from PubChem (CID 155275180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).