N,5-diethyl-7-methylnonan-4-amine

C14H31N — CID 83051953

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

About N,5-diethyl-7-methylnonan-4-amine

N,5-diethyl-7-methylnonan-4-amine (PubChem CID 83051953) has the molecular formula C14H31N and a molecular weight of 213.41 g/mol. Its IUPAC name is N,5-diethyl-7-methylnonan-4-amine.

Molecular Properties

Compound NameN,5-diethyl-7-methylnonan-4-amine
PubChem CID83051953
Molecular FormulaC14H31N
Molecular Weight213.41 g/mol
Exact Mass213.25
IUPAC NameN,5-diethyl-7-methylnonan-4-amine
SMILESCCCC(NCC)C(CC)CC(C)CC
InChIInChI=1S/C14H31N/c1-6-10-14(15-9-4)13(8-3)11-12(5)7-2/h12-15H,6-11H2,1-5H3
InChIKeyCGMMUJSVMVMFOQ-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

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Related Compounds

N,5-diethylnonan-4-amine
CID 83051951
N-ethyl-3,6-dimethyloctan-4-amine
CID 63717606
3-butan-2-ylsulfinyl-N-ethylheptan-4-amine
CID 64651485
5-(difluoromethyl)-3-methyloctane
CID 154668237
N-ethyl-1,1-dimethoxy-4-methylhexan-2-amine
CID 79492342
N-ethyl-2,3,6-trimethylnonan-4-amine
CID 115845744
N-ethyl-1,1-difluoropentan-2-amine
CID 80604281
N,5-diethylpentadecan-6-amine
CID 115831438
(4S)-N-ethyl-5-methylnonan-4-amine
CID 138564824
N-ethyl-2,2,3-trimethylheptan-4-amine
CID 83050802
5-ethyl-3,6,8-trimethyldecane
CID 173141656
3,5,7,9,11,13,15-heptamethyloctadecane
CID 20645188

Frequently Asked Questions

What is the IUPAC name of N,5-diethyl-7-methylnonan-4-amine?
The IUPAC name of N,5-diethyl-7-methylnonan-4-amine (CID 83051953) is N,5-diethyl-7-methylnonan-4-amine.
What is the SMILES notation for N,5-diethyl-7-methylnonan-4-amine?
The canonical SMILES for N,5-diethyl-7-methylnonan-4-amine is CCCC(NCC)C(CC)CC(C)CC.
What is the InChIKey of N,5-diethyl-7-methylnonan-4-amine?
The InChIKey is CGMMUJSVMVMFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31N/c1-6-10-14(15-9-4)13(8-3)11-12(5)7-2/h12-15H,6-11H2,1-5H3.
What are the key properties of N,5-diethyl-7-methylnonan-4-amine?
N,5-diethyl-7-methylnonan-4-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,5-diethyl-7-methylnonan-4-amine is sourced from PubChem (CID 83051953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).