2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride

C8H20ClN — CID 519535

IUPAC2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
SMILESCC(C)CNCC(C)C.Cl
InChIInChI=1S/C8H19N.ClH/c1-7(2)5-9-6-8(3)4;/h7-9H,5-6H2,1-4H3;1H
InChIKeyHDSBLUHKYYCLEZ-UHFFFAOYSA-N
MW165.71 g/mol
LogP2.31
Rot. Bonds4

About 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride

2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride (PubChem CID 519535) has the molecular formula C8H20ClN and a molecular weight of 165.71 g/mol. Its IUPAC name is 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride.

Molecular Properties

Compound Name2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
PubChem CID519535
Molecular FormulaC8H20ClN
Molecular Weight165.71 g/mol
Exact Mass165.13
IUPAC Name2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride
SMILESCC(C)CNCC(C)C.Cl
InChIInChI=1S/C8H19N.ClH/c1-7(2)5-9-6-8(3)4;/h7-9H,5-6H2,1-4H3;1H
InChIKeyHDSBLUHKYYCLEZ-UHFFFAOYSA-N
XLogP2.31
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.71
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

CID 175939227
CID 175939227
(2R)-1-(2-methylpropylamino)propan-2-ol
CID 777887
N,N'-bis[2-(2-methylpropylamino)ethyl]ethane-1,2-diamine
CID 54452976
2-methyl-1-(2-methylpropoxy)propane;2-methyl-N-(2-methylpropyl)propan-1-amine
CID 167710729
1-N-(2-methylpropyl)-2-N-propan-2-ylpropane-1,2-diamine
CID 62569750
2,3,5-trimethyl-N-(2-methylpropyl)hexan-1-amine
CID 81015110
2-methyl-N-(silylmethyl)propan-1-amine
CID 175599866
(2S)-1-(2-methylpropylamino)butan-2-ol
CID 130500218
sodium;2-methyl-N-(2-methylpropyl)propan-1-amine;carbamodithioate
CID 175814248
2-methyl-N-(2-propan-2-yloxypropyl)propan-1-amine
CID 62444418
2-methyl-N-propylpropan-1-amine
CID 520943
2,4-diethyl-N-(2-methylpropyl)hexan-1-amine
CID 82930447

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride?
The IUPAC name of 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride (CID 519535) is 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride.
What is the SMILES notation for 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride?
The canonical SMILES for 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride is CC(C)CNCC(C)C.Cl.
What is the InChIKey of 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride?
The InChIKey is HDSBLUHKYYCLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.ClH/c1-7(2)5-9-6-8(3)4;/h7-9H,5-6H2,1-4H3;1H.
What are the key properties of 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride?
2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride has a molecular weight of 165.71 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methylpropyl)propan-1-amine;hydrochloride is sourced from PubChem (CID 519535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).