N-ethyl-2,8-dimethylnonan-5-amine

C13H29N — CID 62603927

IUPACN-ethyl-2,8-dimethylnonan-5-amine
SMILESCCNC(CCC(C)C)CCC(C)C
InChIInChI=1S/C13H29N/c1-6-14-13(9-7-11(2)3)10-8-12(4)5/h11-14H,6-10H2,1-5H3
InChIKeyXCPGPKBUNRRZFT-UHFFFAOYSA-N
MW199.38 g/mol
LogP3.84
Rot. Bonds8

About N-ethyl-2,8-dimethylnonan-5-amine

N-ethyl-2,8-dimethylnonan-5-amine (PubChem CID 62603927) has the molecular formula C13H29N and a molecular weight of 199.38 g/mol. Its IUPAC name is N-ethyl-2,8-dimethylnonan-5-amine.

Molecular Properties

Compound NameN-ethyl-2,8-dimethylnonan-5-amine
PubChem CID62603927
Molecular FormulaC13H29N
Molecular Weight199.38 g/mol
Exact Mass199.23
IUPAC NameN-ethyl-2,8-dimethylnonan-5-amine
SMILESCCNC(CCC(C)C)CCC(C)C
InChIInChI=1S/C13H29N/c1-6-14-13(9-7-11(2)3)10-8-12(4)5/h11-14H,6-10H2,1-5H3
InChIKeyXCPGPKBUNRRZFT-UHFFFAOYSA-N
XLogP3.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.38
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-6-methyl-1-methylsulfonylheptan-3-amine
CID 62604483
1-cyclopropyl-N-ethyl-5-methylhexan-2-amine
CID 64906798
N-ethyl-5-methylhexan-2-amine
CID 24689543
1-cyclobutyl-N-ethyl-5-methylhexan-2-amine
CID 65458371
N-ethyl-2-methylheptadecan-6-amine
CID 105028964
N-ethyl-6-methyl-1-(1-methylimidazol-2-yl)heptan-3-amine
CID 114530055
N-ethyl-6-methyl-1-pyridin-3-ylheptan-3-amine
CID 105127205
N-ethyl-5-methyl-1-(4-methylphenyl)sulfanylhexan-2-amine
CID 66066786
N-ethyl-5-methyl-1-thiophen-2-ylhexan-2-amine
CID 61065868
N-ethyl-1-(4-methoxyphenyl)-5-methylhexan-2-amine
CID 61066425
1-ethoxy-7-methyl-N-propyloctan-4-amine
CID 105127229
1-(4-chlorophenyl)sulfanyl-N-ethyl-5-methylhexan-2-amine
CID 66144962

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,8-dimethylnonan-5-amine?
The IUPAC name of N-ethyl-2,8-dimethylnonan-5-amine (CID 62603927) is N-ethyl-2,8-dimethylnonan-5-amine.
What is the SMILES notation for N-ethyl-2,8-dimethylnonan-5-amine?
The canonical SMILES for N-ethyl-2,8-dimethylnonan-5-amine is CCNC(CCC(C)C)CCC(C)C.
What is the InChIKey of N-ethyl-2,8-dimethylnonan-5-amine?
The InChIKey is XCPGPKBUNRRZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29N/c1-6-14-13(9-7-11(2)3)10-8-12(4)5/h11-14H,6-10H2,1-5H3.
What are the key properties of N-ethyl-2,8-dimethylnonan-5-amine?
N-ethyl-2,8-dimethylnonan-5-amine has a molecular weight of 199.38 g/mol, XLogP of 3.84, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,8-dimethylnonan-5-amine is sourced from PubChem (CID 62603927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).