N,N,8-trimethyl-5-propylnonan-1-amine

C15H33N — CID 123144577

IUPACN,N,8-trimethyl-5-propylnonan-1-amine
SMILESCCCC(CCCCN(C)C)CCC(C)C
InChIInChI=1S/C15H33N/c1-6-9-15(12-11-14(2)3)10-7-8-13-16(4)5/h14-15H,6-13H2,1-5H3
InChIKeyQCTRWTRUXDACFX-UHFFFAOYSA-N
MW227.44 g/mol
LogP4.57
Rot. Bonds10

About N,N,8-trimethyl-5-propylnonan-1-amine

N,N,8-trimethyl-5-propylnonan-1-amine (PubChem CID 123144577) has the molecular formula C15H33N and a molecular weight of 227.44 g/mol. Its IUPAC name is N,N,8-trimethyl-5-propylnonan-1-amine.

Molecular Properties

Compound NameN,N,8-trimethyl-5-propylnonan-1-amine
PubChem CID123144577
Molecular FormulaC15H33N
Molecular Weight227.44 g/mol
Exact Mass227.26
IUPAC NameN,N,8-trimethyl-5-propylnonan-1-amine
SMILESCCCC(CCCCN(C)C)CCC(C)C
InChIInChI=1S/C15H33N/c1-6-9-15(12-11-14(2)3)10-7-8-13-16(4)5/h14-15H,6-13H2,1-5H3
InChIKeyQCTRWTRUXDACFX-UHFFFAOYSA-N
XLogP4.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.44
LogP ≤ 54.57
H-Bond Donors ≤ 50
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-5-propyltridecane
CID 123255718
(5R)-2-methyl-5-propylnonane
CID 162842430
2,8-dimethyl-5-propylnonane
CID 57014492
ethane;2-methyl-5-propylnonane
CID 171073854
N,N,5-trimethyl-2-propylhexan-1-amine
CID 123395746
N,N-dimethyl-4-pentyldecan-1-amine
CID 154963901
N,N,20-trimethylhenicosan-1-amine;hydrochloride
CID 173055097
4-[3-(dimethylamino)propyl]-N,N,N',N'-tetramethylheptane-1,7-diamine
CID 58251491
2-methyl-6-propyldodecane
CID 545626
20-ethyl-N,N-dimethyltetracosan-1-amine;hydrochloride
CID 172995497
N,N-dimethyldodecan-1-amine;14-methylpentadecan-1-amine
CID 88621765
5-dodecyl-N,N-dimethyl-9,15-dimethylidene-12-propylpentacosan-1-amine
CID 166716171

Frequently Asked Questions

What is the IUPAC name of N,N,8-trimethyl-5-propylnonan-1-amine?
The IUPAC name of N,N,8-trimethyl-5-propylnonan-1-amine (CID 123144577) is N,N,8-trimethyl-5-propylnonan-1-amine.
What is the SMILES notation for N,N,8-trimethyl-5-propylnonan-1-amine?
The canonical SMILES for N,N,8-trimethyl-5-propylnonan-1-amine is CCCC(CCCCN(C)C)CCC(C)C.
What is the InChIKey of N,N,8-trimethyl-5-propylnonan-1-amine?
The InChIKey is QCTRWTRUXDACFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N/c1-6-9-15(12-11-14(2)3)10-7-8-13-16(4)5/h14-15H,6-13H2,1-5H3.
What are the key properties of N,N,8-trimethyl-5-propylnonan-1-amine?
N,N,8-trimethyl-5-propylnonan-1-amine has a molecular weight of 227.44 g/mol, XLogP of 4.57, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,8-trimethyl-5-propylnonan-1-amine is sourced from PubChem (CID 123144577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).