N-ethyl-3-propan-2-ylnonan-2-amine

C14H31N — CID 63401515

IUPACN-ethyl-3-propan-2-ylnonan-2-amine
SMILESCCCCCCC(C(C)C)C(C)NCC
InChIInChI=1S/C14H31N/c1-6-8-9-10-11-14(12(3)4)13(5)15-7-2/h12-15H,6-11H2,1-5H3
InChIKeyUDCUHQLDRPNXGY-UHFFFAOYSA-N
MW213.41 g/mol
LogP4.23
Rot. Bonds9

About N-ethyl-3-propan-2-ylnonan-2-amine

N-ethyl-3-propan-2-ylnonan-2-amine (PubChem CID 63401515) has the molecular formula C14H31N and a molecular weight of 213.41 g/mol. Its IUPAC name is N-ethyl-3-propan-2-ylnonan-2-amine.

Molecular Properties

Compound NameN-ethyl-3-propan-2-ylnonan-2-amine
PubChem CID63401515
Molecular FormulaC14H31N
Molecular Weight213.41 g/mol
Exact Mass213.25
IUPAC NameN-ethyl-3-propan-2-ylnonan-2-amine
SMILESCCCCCCC(C(C)C)C(C)NCC
InChIInChI=1S/C14H31N/c1-6-8-9-10-11-14(12(3)4)13(5)15-7-2/h12-15H,6-11H2,1-5H3
InChIKeyUDCUHQLDRPNXGY-UHFFFAOYSA-N
XLogP4.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.41
LogP ≤ 54.23
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-methyl-3-propan-2-yltetradecane
CID 154298453
3-propan-2-yldodecan-2-amine
CID 63401694
3-propan-2-yltridecan-2-amine
CID 63401691
3-propan-2-yldecan-2-amine
CID 63401734
5-methyl-4-propan-2-yltetradecane
CID 123996280
N-ethyl-5-methyltridecan-6-amine
CID 114246331
3-(2-ethoxyethyl)-N-ethyl-4-methylpentan-2-amine
CID 62915827
N-ethyl-2,3-dimethylundecan-4-amine
CID 115832523
N-ethyl-2,3-dimethyldecan-4-amine
CID 115833855
N-ethyl-2-methylheptadecan-6-amine
CID 105028964
N-ethyltetradecan-7-amine
CID 87847195
1-N,1-N'-diethyldecane-1,1-diamine
CID 141499810

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-propan-2-ylnonan-2-amine?
The IUPAC name of N-ethyl-3-propan-2-ylnonan-2-amine (CID 63401515) is N-ethyl-3-propan-2-ylnonan-2-amine.
What is the SMILES notation for N-ethyl-3-propan-2-ylnonan-2-amine?
The canonical SMILES for N-ethyl-3-propan-2-ylnonan-2-amine is CCCCCCC(C(C)C)C(C)NCC.
What is the InChIKey of N-ethyl-3-propan-2-ylnonan-2-amine?
The InChIKey is UDCUHQLDRPNXGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N/c1-6-8-9-10-11-14(12(3)4)13(5)15-7-2/h12-15H,6-11H2,1-5H3.
What are the key properties of N-ethyl-3-propan-2-ylnonan-2-amine?
N-ethyl-3-propan-2-ylnonan-2-amine has a molecular weight of 213.41 g/mol, XLogP of 4.23, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-propan-2-ylnonan-2-amine is sourced from PubChem (CID 63401515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).