N,N-dimethyl-6-methylidenenonan-1-amine

C12H25N — CID 123575640

IUPACN,N-dimethyl-6-methylidenenonan-1-amine
SMILESC=C(CCC)CCCCCN(C)C
InChIInChI=1S/C12H25N/c1-5-9-12(2)10-7-6-8-11-13(3)4/h2,5-11H2,1,3-4H3
InChIKeyNSOGCMJZQFDHNV-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.46
Rot. Bonds8

About N,N-dimethyl-6-methylidenenonan-1-amine

N,N-dimethyl-6-methylidenenonan-1-amine (PubChem CID 123575640) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N,N-dimethyl-6-methylidenenonan-1-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-methylidenenonan-1-amine
PubChem CID123575640
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN,N-dimethyl-6-methylidenenonan-1-amine
SMILESC=C(CCC)CCCCCN(C)C
InChIInChI=1S/C12H25N/c1-5-9-12(2)10-7-6-8-11-13(3)4/h2,5-11H2,1,3-4H3
InChIKeyNSOGCMJZQFDHNV-UHFFFAOYSA-N
XLogP3.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-methylidenenonan-1-amine?
The IUPAC name of N,N-dimethyl-6-methylidenenonan-1-amine (CID 123575640) is N,N-dimethyl-6-methylidenenonan-1-amine.
What is the SMILES notation for N,N-dimethyl-6-methylidenenonan-1-amine?
The canonical SMILES for N,N-dimethyl-6-methylidenenonan-1-amine is C=C(CCC)CCCCCN(C)C.
What is the InChIKey of N,N-dimethyl-6-methylidenenonan-1-amine?
The InChIKey is NSOGCMJZQFDHNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-5-9-12(2)10-7-6-8-11-13(3)4/h2,5-11H2,1,3-4H3.
What are the key properties of N,N-dimethyl-6-methylidenenonan-1-amine?
N,N-dimethyl-6-methylidenenonan-1-amine has a molecular weight of 183.34 g/mol, XLogP of 3.46, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-methylidenenonan-1-amine is sourced from PubChem (CID 123575640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).