3-ethyl-4,4-dimethylpentan-1-amine

C9H21N — CID 134419150

IUPAC3-ethyl-4,4-dimethylpentan-1-amine
SMILESCCC(CCN)C(C)(C)C
InChIInChI=1S/C9H21N/c1-5-8(6-7-10)9(2,3)4/h8H,5-7,10H2,1-4H3
InChIKeyRQPVFCUESDFIQT-UHFFFAOYSA-N
MW143.27 g/mol
LogP2.41
Rot. Bonds3

About 3-ethyl-4,4-dimethylpentan-1-amine

3-ethyl-4,4-dimethylpentan-1-amine (PubChem CID 134419150) has the molecular formula C9H21N and a molecular weight of 143.27 g/mol. Its IUPAC name is 3-ethyl-4,4-dimethylpentan-1-amine.

Molecular Properties

Compound Name3-ethyl-4,4-dimethylpentan-1-amine
PubChem CID134419150
Molecular FormulaC9H21N
Molecular Weight143.27 g/mol
Exact Mass143.17
IUPAC Name3-ethyl-4,4-dimethylpentan-1-amine
SMILESCCC(CCN)C(C)(C)C
InChIInChI=1S/C9H21N/c1-5-8(6-7-10)9(2,3)4/h8H,5-7,10H2,1-4H3
InChIKeyRQPVFCUESDFIQT-UHFFFAOYSA-N
XLogP2.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.27
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyl-4-fluoro-4-methylpentan-1-amine
CID 105429104
3-ethyl-2,2-dimethylheptane
CID 20686447
3-(methoxymethyl)-4,4-dimethylpentan-1-amine
CID 115012519
5-amino-2-tert-butylpentan-1-ol
CID 59516739
3-tert-butyl-N'-[1-(dimethylamino)propan-2-yl]-N'-ethylhexane-1,6-diamine
CID 103189561
azane;4,4-bis(3-aminopropyl)-5-ethyloctane-1,8-diamine
CID 87669498
5-amino-3-(aminomethyl)-2-methylpentan-2-ol
CID 173461843
3-ethyl-5,5-dimethylhexan-1-amine
CID 83682161
6-tert-butylundecane
CID 90714582
1-amino-4,4-dimethylpentan-3-ol
CID 55283756
2,7-diethyl-8,8-dimethylnonanoic acid
CID 175153792
3-[(2-methylpropan-2-yl)oxy]pentan-1-amine
CID 43368459

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4,4-dimethylpentan-1-amine?
The IUPAC name of 3-ethyl-4,4-dimethylpentan-1-amine (CID 134419150) is 3-ethyl-4,4-dimethylpentan-1-amine.
What is the SMILES notation for 3-ethyl-4,4-dimethylpentan-1-amine?
The canonical SMILES for 3-ethyl-4,4-dimethylpentan-1-amine is CCC(CCN)C(C)(C)C.
What is the InChIKey of 3-ethyl-4,4-dimethylpentan-1-amine?
The InChIKey is RQPVFCUESDFIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N/c1-5-8(6-7-10)9(2,3)4/h8H,5-7,10H2,1-4H3.
What are the key properties of 3-ethyl-4,4-dimethylpentan-1-amine?
3-ethyl-4,4-dimethylpentan-1-amine has a molecular weight of 143.27 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4,4-dimethylpentan-1-amine is sourced from PubChem (CID 134419150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).