N,N-dimethyl-4-methylideneheptan-1-amine

C10H21N — CID 130193629

IUPACN,N-dimethyl-4-methylideneheptan-1-amine
SMILESC=C(CCC)CCCN(C)C
InChIInChI=1S/C10H21N/c1-5-7-10(2)8-6-9-11(3)4/h2,5-9H2,1,3-4H3
InChIKeyHAGFUJVRIHTHSF-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.68
Rot. Bonds6

About N,N-dimethyl-4-methylideneheptan-1-amine

N,N-dimethyl-4-methylideneheptan-1-amine (PubChem CID 130193629) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is N,N-dimethyl-4-methylideneheptan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-methylideneheptan-1-amine
PubChem CID130193629
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC NameN,N-dimethyl-4-methylideneheptan-1-amine
SMILESC=C(CCC)CCCN(C)C
InChIInChI=1S/C10H21N/c1-5-7-10(2)8-6-9-11(3)4/h2,5-9H2,1,3-4H3
InChIKeyHAGFUJVRIHTHSF-UHFFFAOYSA-N
XLogP2.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-methylideneheptan-1-amine?
The IUPAC name of N,N-dimethyl-4-methylideneheptan-1-amine (CID 130193629) is N,N-dimethyl-4-methylideneheptan-1-amine.
What is the SMILES notation for N,N-dimethyl-4-methylideneheptan-1-amine?
The canonical SMILES for N,N-dimethyl-4-methylideneheptan-1-amine is C=C(CCC)CCCN(C)C.
What is the InChIKey of N,N-dimethyl-4-methylideneheptan-1-amine?
The InChIKey is HAGFUJVRIHTHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-5-7-10(2)8-6-9-11(3)4/h2,5-9H2,1,3-4H3.
What are the key properties of N,N-dimethyl-4-methylideneheptan-1-amine?
N,N-dimethyl-4-methylideneheptan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.68, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-methylideneheptan-1-amine is sourced from PubChem (CID 130193629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).