2-imino-N,N-dimethyl-3-methylidenepentan-1-amine

C8H16N2 — CID 134408182

IUPAC2-imino-N,N-dimethyl-3-methylidenepentan-1-amine
SMILES[H]/N=C(\CN(C)C)C(=C)CC
InChIInChI=1S/C8H16N2/c1-5-7(2)8(9)6-10(3)4/h9H,2,5-6H2,1,3-4H3/b9-8+
InChIKeyHOTXXXBJZZTBCO-CMDGGOBGSA-N
MW140.23 g/mol
LogP1.53
Rot. Bonds4

About 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine

2-imino-N,N-dimethyl-3-methylidenepentan-1-amine (PubChem CID 134408182) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine.

Molecular Properties

Compound Name2-imino-N,N-dimethyl-3-methylidenepentan-1-amine
PubChem CID134408182
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name2-imino-N,N-dimethyl-3-methylidenepentan-1-amine
SMILES[H]/N=C(\CN(C)C)C(=C)CC
InChIInChI=1S/C8H16N2/c1-5-7(2)8(9)6-10(3)4/h9H,2,5-6H2,1,3-4H3/b9-8+
InChIKeyHOTXXXBJZZTBCO-CMDGGOBGSA-N
XLogP1.53
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine?
The IUPAC name of 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine (CID 134408182) is 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine.
What is the SMILES notation for 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine?
The canonical SMILES for 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine is [H]/N=C(\CN(C)C)C(=C)CC.
What is the InChIKey of 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine?
The InChIKey is HOTXXXBJZZTBCO-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H16N2/c1-5-7(2)8(9)6-10(3)4/h9H,2,5-6H2,1,3-4H3/b9-8+.
What are the key properties of 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine?
2-imino-N,N-dimethyl-3-methylidenepentan-1-amine has a molecular weight of 140.23 g/mol, XLogP of 1.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imino-N,N-dimethyl-3-methylidenepentan-1-amine is sourced from PubChem (CID 134408182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).