N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine

C14H29N — CID 155010405

IUPACN,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine
SMILESC=CCN(C)CC(C)CC(C)C(C)CC
InChIInChI=1S/C14H29N/c1-7-9-15(6)11-12(3)10-14(5)13(4)8-2/h7,12-14H,1,8-11H2,2-6H3
InChIKeyCKQYPUWGVSHSPS-UHFFFAOYSA-N
MW211.39 g/mol
LogP3.81
Rot. Bonds8

About N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine

N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine (PubChem CID 155010405) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine.

Molecular Properties

Compound NameN,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine
PubChem CID155010405
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC NameN,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine
SMILESC=CCN(C)CC(C)CC(C)C(C)CC
InChIInChI=1S/C14H29N/c1-7-9-15(6)11-12(3)10-14(5)13(4)8-2/h7,12-14H,1,8-11H2,2-6H3
InChIKeyCKQYPUWGVSHSPS-UHFFFAOYSA-N
XLogP3.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(2R)-1-N-methyl-1-N-prop-2-enylbutane-1,2-diamine
CID 130522843
2-ethyl-N-methyl-N-prop-2-enylhexan-1-amine
CID 88673133
3,5,6-trimethyloct-1-ene
CID 90839581
N-methyl-N-prop-2-enylprop-2-en-1-amine;hydroiodide
CID 141311417
(2S,3R)-3-methyl-1-N,1-N-bis(prop-2-enyl)pentane-1,2-diamine
CID 28596727
N-ethyl-N,2-dimethylpent-4-en-1-amine
CID 139352372
(2R)-N,N,2,3-tetramethylpentan-1-amine
CID 130182039
1-methoxy-2,4,5-trimethylheptane
CID 177138936
4,5,6-trimethyloct-1-ene
CID 91354249
(2S)-1-methoxy-N-methyl-N-prop-2-enylpropan-2-amine
CID 171624070
(2S)-N-ethyl-N,2-dimethylbutan-1-amine
CID 89086806
1-[(3R)-2-ethenyl-3-methylpentyl]-1,2,2-trimethylhydrazine
CID 139366079

Frequently Asked Questions

What is the IUPAC name of N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine?
The IUPAC name of N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine (CID 155010405) is N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine.
What is the SMILES notation for N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine?
The canonical SMILES for N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine is C=CCN(C)CC(C)CC(C)C(C)CC.
What is the InChIKey of N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine?
The InChIKey is CKQYPUWGVSHSPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-7-9-15(6)11-12(3)10-14(5)13(4)8-2/h7,12-14H,1,8-11H2,2-6H3.
What are the key properties of N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine?
N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine has a molecular weight of 211.39 g/mol, XLogP of 3.81, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,4,5-tetramethyl-N-prop-2-enylheptan-1-amine is sourced from PubChem (CID 155010405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).