2-(2-methylpropyl)decan-1-amine

C14H31N — CID 63498111

IUPAC2-(2-methylpropyl)decan-1-amine
SMILESCCCCCCCCC(CN)CC(C)C
InChIInChI=1S/C14H31N/c1-4-5-6-7-8-9-10-14(12-15)11-13(2)3/h13-14H,4-12,15H2,1-3H3
InChIKeyCADQFNIYCQAQOU-UHFFFAOYSA-N
MW213.41 g/mol
LogP4.36
Rot. Bonds10

About 2-(2-methylpropyl)decan-1-amine

2-(2-methylpropyl)decan-1-amine (PubChem CID 63498111) has the molecular formula C14H31N and a molecular weight of 213.41 g/mol. Its IUPAC name is 2-(2-methylpropyl)decan-1-amine.

Molecular Properties

Compound Name2-(2-methylpropyl)decan-1-amine
PubChem CID63498111
Molecular FormulaC14H31N
Molecular Weight213.41 g/mol
Exact Mass213.25
IUPAC Name2-(2-methylpropyl)decan-1-amine
SMILESCCCCCCCCC(CN)CC(C)C
InChIInChI=1S/C14H31N/c1-4-5-6-7-8-9-10-14(12-15)11-13(2)3/h13-14H,4-12,15H2,1-3H3
InChIKeyCADQFNIYCQAQOU-UHFFFAOYSA-N
XLogP4.36
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.41
LogP ≤ 54.36
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-(2-methylpropyl)heptan-1-amine
CID 62505521
(2S)-2-hexyldecan-1-amine
CID 129368307
2-dodecylhexadecan-1-amine
CID 23048605
2-hexyloctadecan-1-amine
CID 87546751
4-ethyl-2-methyldecane
CID 19893744
2-(2-methylpropyl)-N'-octylbutane-1,4-diamine
CID 113337410
4-(bromomethyl)-2-methylundecane
CID 66049402
2-(2-methylpropyl)undecan-1-ol
CID 66059386
4-(chloromethyl)-2-methyltridecane
CID 66035866
2-(fluoromethyl)henicosan-1-amine
CID 175054402
2-propylheptan-1-amine
CID 21267775
2-[2-(2-methylpropyl)nonoxy]ethanamine
CID 150465081

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)decan-1-amine?
The IUPAC name of 2-(2-methylpropyl)decan-1-amine (CID 63498111) is 2-(2-methylpropyl)decan-1-amine.
What is the SMILES notation for 2-(2-methylpropyl)decan-1-amine?
The canonical SMILES for 2-(2-methylpropyl)decan-1-amine is CCCCCCCCC(CN)CC(C)C.
What is the InChIKey of 2-(2-methylpropyl)decan-1-amine?
The InChIKey is CADQFNIYCQAQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-14(12-15)11-13(2)3/h13-14H,4-12,15H2,1-3H3.
What are the key properties of 2-(2-methylpropyl)decan-1-amine?
2-(2-methylpropyl)decan-1-amine has a molecular weight of 213.41 g/mol, XLogP of 4.36, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)decan-1-amine is sourced from PubChem (CID 63498111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).