ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine

C10H27N3 — CID 172586990

IUPACethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine
SMILESCC.CNNCC(C)CCN(C)C
InChIInChI=1S/C8H21N3.C2H6/c1-8(7-10-9-2)5-6-11(3)4;1-2/h8-10H,5-7H2,1-4H3;1-2H3
InChIKeyKOISEIBFJXGXAW-UHFFFAOYSA-N
MW189.35 g/mol
LogP1.32
Rot. Bonds6

About ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine

ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine (PubChem CID 172586990) has the molecular formula C10H27N3 and a molecular weight of 189.35 g/mol. Its IUPAC name is ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine.

Molecular Properties

Compound Nameethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine
PubChem CID172586990
Molecular FormulaC10H27N3
Molecular Weight189.35 g/mol
Exact Mass189.22
IUPAC Nameethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine
SMILESCC.CNNCC(C)CCN(C)C
InChIInChI=1S/C8H21N3.C2H6/c1-8(7-10-9-2)5-6-11(3)4;1-2/h8-10H,5-7H2,1-4H3;1-2H3
InChIKeyKOISEIBFJXGXAW-UHFFFAOYSA-N
XLogP1.32
TPSA27.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.35
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[4-(dimethylamino)-2-methylbutyl]cyclopropanecarboxamide;ethane
CID 166075449
N',N',2-trimethyl-N,N-dipropylbutane-1,4-diamine
CID 23198614
ethane;methanamine;N,N,3-trimethylbutan-1-amine
CID 143170086
2-fluoro-N,N',N'-trimethylbutane-1,4-diamine
CID 175905976
1-N,1-N,3-N-trimethyl-3-N-(3-methylpentyl)butane-1,3-diamine
CID 166139395
1-N'-methyl-1-N'-[1-(2-methylhydrazinyl)propan-2-yl]ethane-1,1-diamine
CID 134341698
ethane;3-methoxy-N,N-dimethylbutan-1-amine
CID 144600046
propane;N,N,3-trimethylbutan-1-amine
CID 144828505
3-(dimethylamino)propane-1,1-diol;hydrochloride
CID 173336782
3-fluoro-N,N-dimethylbutan-1-amine
CID 142449569
N,N,3-trimethyloct-6-yn-1-amine
CID 170193044
1-N,1-N,3-N,7-tetramethyloctane-1,3-diamine
CID 83160965

Frequently Asked Questions

What is the IUPAC name of ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine?
The IUPAC name of ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine (CID 172586990) is ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine.
What is the SMILES notation for ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine?
The canonical SMILES for ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine is CC.CNNCC(C)CCN(C)C.
What is the InChIKey of ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine?
The InChIKey is KOISEIBFJXGXAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H21N3.C2H6/c1-8(7-10-9-2)5-6-11(3)4;1-2/h8-10H,5-7H2,1-4H3;1-2H3.
What are the key properties of ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine?
ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine has a molecular weight of 189.35 g/mol, XLogP of 1.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N,N,3-trimethyl-4-(2-methylhydrazinyl)butan-1-amine is sourced from PubChem (CID 172586990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).