7-methyl-6-methylideneoctan-1-amine

C10H21N — CID 129099714

IUPAC7-methyl-6-methylideneoctan-1-amine
SMILESC=C(CCCCCN)C(C)C
InChIInChI=1S/C10H21N/c1-9(2)10(3)7-5-4-6-8-11/h9H,3-8,11H2,1-2H3
InChIKeyPIFILRHNIDVJFP-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.72
Rot. Bonds6

About 7-methyl-6-methylideneoctan-1-amine

7-methyl-6-methylideneoctan-1-amine (PubChem CID 129099714) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 7-methyl-6-methylideneoctan-1-amine.

Molecular Properties

Compound Name7-methyl-6-methylideneoctan-1-amine
PubChem CID129099714
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name7-methyl-6-methylideneoctan-1-amine
SMILESC=C(CCCCCN)C(C)C
InChIInChI=1S/C10H21N/c1-9(2)10(3)7-5-4-6-8-11/h9H,3-8,11H2,1-2H3
InChIKeyPIFILRHNIDVJFP-UHFFFAOYSA-N
XLogP2.72
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.72
H-Bond Donors ≤ 51
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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Related Compounds

8-methyl-7-methylidenenonan-1-amine
CID 174252779
5-methyl-4-methylidenenonane-1,9-diamine
CID 174330034
2,18-dimethyl-3-methylideneicosane
CID 123398512
12-methyl-11-methylidene-N-propan-2-yltridecan-1-amine
CID 138727244
dodec-11-ene-1,11-diamine
CID 88786698
10-amino-2-methyldecan-4-one
CID 116551412
hexane-1,6-diamine;2-methylpropanoic acid
CID 21426939
7-amino-6-methylideneoctan-1-ol
CID 91152854
5,7-dimethyl-6-methylideneoctan-1-amine
CID 129100170
2,7-dimethyl-6-methylideneoctane-3-thione
CID 129154835
6-(7-aminohept-1-en-2-ylsulfanyl)hept-6-en-1-amine
CID 54573847
N,13-dimethyl-12-methylidene-N-(3-methylpent-1-en-2-yl)tetradecan-1-amine
CID 155245297

Frequently Asked Questions

What is the IUPAC name of 7-methyl-6-methylideneoctan-1-amine?
The IUPAC name of 7-methyl-6-methylideneoctan-1-amine (CID 129099714) is 7-methyl-6-methylideneoctan-1-amine.
What is the SMILES notation for 7-methyl-6-methylideneoctan-1-amine?
The canonical SMILES for 7-methyl-6-methylideneoctan-1-amine is C=C(CCCCCN)C(C)C.
What is the InChIKey of 7-methyl-6-methylideneoctan-1-amine?
The InChIKey is PIFILRHNIDVJFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-9(2)10(3)7-5-4-6-8-11/h9H,3-8,11H2,1-2H3.
What are the key properties of 7-methyl-6-methylideneoctan-1-amine?
7-methyl-6-methylideneoctan-1-amine has a molecular weight of 155.28 g/mol, XLogP of 2.72, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-6-methylideneoctan-1-amine is sourced from PubChem (CID 129099714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).