2-methylnonan-1-amine

C10H23N — CID 21396878

IUPAC2-methylnonan-1-amine
SMILESCCCCCCCC(C)CN
InChIInChI=1S/C10H23N/c1-3-4-5-6-7-8-10(2)9-11/h10H,3-9,11H2,1-2H3
InChIKeyYUHZZTIELHYAAB-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.94
Rot. Bonds7

About 2-methylnonan-1-amine

2-methylnonan-1-amine (PubChem CID 21396878) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is 2-methylnonan-1-amine.

Molecular Properties

Compound Name2-methylnonan-1-amine
PubChem CID21396878
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Name2-methylnonan-1-amine
SMILESCCCCCCCC(C)CN
InChIInChI=1S/C10H23N/c1-3-4-5-6-7-8-10(2)9-11/h10H,3-9,11H2,1-2H3
InChIKeyYUHZZTIELHYAAB-UHFFFAOYSA-N
XLogP2.94
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-methyltricosan-1-amine
CID 87547792
2-methyloctadecan-1-amine
CID 56980469
2,4-dimethylnonan-1-amine
CID 123882027
10,16-dimethyldotriacontane
CID 91748795
6-methyloctacosane
CID 22223942
27-methyltripentacontane
CID 91450521
8,13-dimethyloctacosane
CID 71323274
15-methylhexatriacontane
CID 86002594
6-methylheptacosane
CID 22223776
15-methyldotriacontane
CID 54168480
20-methyltetracontane
CID 20659070
8-methyloctacosane
CID 22224109

Frequently Asked Questions

What is the IUPAC name of 2-methylnonan-1-amine?
The IUPAC name of 2-methylnonan-1-amine (CID 21396878) is 2-methylnonan-1-amine.
What is the SMILES notation for 2-methylnonan-1-amine?
The canonical SMILES for 2-methylnonan-1-amine is CCCCCCCC(C)CN.
What is the InChIKey of 2-methylnonan-1-amine?
The InChIKey is YUHZZTIELHYAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-3-4-5-6-7-8-10(2)9-11/h10H,3-9,11H2,1-2H3.
What are the key properties of 2-methylnonan-1-amine?
2-methylnonan-1-amine has a molecular weight of 157.30 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylnonan-1-amine is sourced from PubChem (CID 21396878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).