N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine

C16H25N3 — CID 105001190

IUPACN,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine
SMILESCCC(C)CC(Cc1nn(C)c2ccccc12)NC
InChIInChI=1S/C16H25N3/c1-5-12(2)10-13(17-3)11-15-14-8-6-7-9-16(14)19(4)18-15/h6-9,12-13,17H,5,10-11H2,1-4H3
InChIKeyIKVWMXWXFHQSFK-UHFFFAOYSA-N
MW259.40 g/mol
LogP3.14
Rot. Bonds6

About N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine

N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine (PubChem CID 105001190) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine.

Molecular Properties

Compound NameN,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine
PubChem CID105001190
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC NameN,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine
SMILESCCC(C)CC(Cc1nn(C)c2ccccc12)NC
InChIInChI=1S/C16H25N3/c1-5-12(2)10-13(17-3)11-15-14-8-6-7-9-16(14)19(4)18-15/h6-9,12-13,17H,5,10-11H2,1-4H3
InChIKeyIKVWMXWXFHQSFK-UHFFFAOYSA-N
XLogP3.14
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-1-(1-methylindazol-3-yl)-N-propylhexan-2-amine
CID 105001229
N-ethyl-1-(1-methylindazol-3-yl)heptan-2-amine
CID 105001147
1-N,1-N-dimethyl-3-(1-methylindazol-3-yl)-2-N-propylpropane-1,2-diamine
CID 79092451
N,3,3-trimethyl-2-[(1-methylindazol-3-yl)methyl]butan-1-amine
CID 83139294
N-methyl-1-(1-methylindazol-3-yl)-3-methylsulfonylbutan-2-amine
CID 105001238
4-methyl-1-(1-methylindazol-3-yl)hexan-2-one
CID 115778384
3-methyl-1-(1-methylindazol-3-yl)pentan-1-ol
CID 103128712
[3-ethyl-1-(1-methylindazol-3-yl)heptan-2-yl]hydrazine
CID 105318169
N,4-dimethyl-1-quinolin-4-ylhexan-2-amine
CID 104997356
N-methyl-1-(1-methylindazol-3-yl)methanamine;hydrochloride
CID 131083250
1-(1,3-dioxolan-2-yl)-N-ethyl-3-(1-methylindazol-3-yl)propan-2-amine
CID 103546905
N-methyl-1-(1-methylimidazol-4-yl)-2-(1-methylindazol-3-yl)ethanamine
CID 107976079

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine?
The IUPAC name of N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine (CID 105001190) is N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine.
What is the SMILES notation for N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine?
The canonical SMILES for N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine is CCC(C)CC(Cc1nn(C)c2ccccc12)NC.
What is the InChIKey of N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine?
The InChIKey is IKVWMXWXFHQSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-5-12(2)10-13(17-3)11-15-14-8-6-7-9-16(14)19(4)18-15/h6-9,12-13,17H,5,10-11H2,1-4H3.
What are the key properties of N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine?
N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine has a molecular weight of 259.40 g/mol, XLogP of 3.14, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-1-(1-methylindazol-3-yl)hexan-2-amine is sourced from PubChem (CID 105001190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).