N,4,8-trimethylnonan-3-amine

C12H27N — CID 83158813

IUPACN,4,8-trimethylnonan-3-amine
SMILESCCC(NC)C(C)CCCC(C)C
InChIInChI=1S/C12H27N/c1-6-12(13-5)11(4)9-7-8-10(2)3/h10-13H,6-9H2,1-5H3
InChIKeyCNHYSBKZFSPRGI-UHFFFAOYSA-N
MW185.35 g/mol
LogP3.45
Rot. Bonds7

About N,4,8-trimethylnonan-3-amine

N,4,8-trimethylnonan-3-amine (PubChem CID 83158813) has the molecular formula C12H27N and a molecular weight of 185.35 g/mol. Its IUPAC name is N,4,8-trimethylnonan-3-amine.

Molecular Properties

Compound NameN,4,8-trimethylnonan-3-amine
PubChem CID83158813
Molecular FormulaC12H27N
Molecular Weight185.35 g/mol
Exact Mass185.21
IUPAC NameN,4,8-trimethylnonan-3-amine
SMILESCCC(NC)C(C)CCCC(C)C
InChIInChI=1S/C12H27N/c1-6-12(13-5)11(4)9-7-8-10(2)3/h10-13H,6-9H2,1-5H3
InChIKeyCNHYSBKZFSPRGI-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.35
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-methoxy-N,4-dimethyloctan-3-amine
CID 104648384
N,4-dimethylhexan-3-amine
CID 63559808
N,5,8-trimethylnonan-4-amine
CID 83047737
7-ethyl-N,2-dimethylundecan-6-amine
CID 105028702
6-ethyl-N,3,10-trimethylundecan-5-amine
CID 174258743
1,1-difluoro-N,6-dimethylheptan-2-amine
CID 103517025
3,7-dimethyl-N-propyloctan-2-amine
CID 83158474
2,6,10,14,18,22,26-heptamethyloctacosane
CID 6428605
N-methyl-3-[[2-methyl-3-(methylamino)pentoxy]methyl]pentan-2-amine
CID 163446158
14-ethyl-2,6,7,10-tetramethylhexadecane
CID 159635838
4-ethyl-N-methylhexan-3-amine
CID 79307570
2,6,10,15,19-pentamethylhenicosane
CID 6428617

Frequently Asked Questions

What is the IUPAC name of N,4,8-trimethylnonan-3-amine?
The IUPAC name of N,4,8-trimethylnonan-3-amine (CID 83158813) is N,4,8-trimethylnonan-3-amine.
What is the SMILES notation for N,4,8-trimethylnonan-3-amine?
The canonical SMILES for N,4,8-trimethylnonan-3-amine is CCC(NC)C(C)CCCC(C)C.
What is the InChIKey of N,4,8-trimethylnonan-3-amine?
The InChIKey is CNHYSBKZFSPRGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N/c1-6-12(13-5)11(4)9-7-8-10(2)3/h10-13H,6-9H2,1-5H3.
What are the key properties of N,4,8-trimethylnonan-3-amine?
N,4,8-trimethylnonan-3-amine has a molecular weight of 185.35 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,8-trimethylnonan-3-amine is sourced from PubChem (CID 83158813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).