1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine

C17H28N2 — CID 43100770

IUPAC1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine
SMILESCC(C)CC(CNC1CCc2ccccc21)N(C)C
InChIInChI=1S/C17H28N2/c1-13(2)11-15(19(3)4)12-18-17-10-9-14-7-5-6-8-16(14)17/h5-8,13,15,17-18H,9-12H2,1-4H3
InChIKeyFYPVMBJPUWRCJD-UHFFFAOYSA-N
MW260.43 g/mol
LogP3.24
Rot. Bonds6

About 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine

1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine (PubChem CID 43100770) has the molecular formula C17H28N2 and a molecular weight of 260.43 g/mol. Its IUPAC name is 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine
PubChem CID43100770
Molecular FormulaC17H28N2
Molecular Weight260.43 g/mol
Exact Mass260.23
IUPAC Name1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine
SMILESCC(C)CC(CNC1CCc2ccccc21)N(C)C
InChIInChI=1S/C17H28N2/c1-13(2)11-15(19(3)4)12-18-17-10-9-14-7-5-6-8-16(14)17/h5-8,13,15,17-18H,9-12H2,1-4H3
InChIKeyFYPVMBJPUWRCJD-UHFFFAOYSA-N
XLogP3.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine with MolForge

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Related Compounds

1-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine
CID 81296468
3-(2,3-dihydro-1H-inden-1-ylamino)-2-methylpropanoic acid
CID 43652106
3-(2,3-dihydro-1H-inden-1-ylamino)-2-methylpropanamide
CID 43652107
N-(2-methyl-3-pyrrolidin-1-ylpropyl)-2,3-dihydro-1H-inden-1-amine
CID 62994581
N-(3-methyl-2-propan-2-ylbutyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 102904359
2-(2,3-dihydro-1H-inden-1-ylamino)-1-phenylethanol
CID 43394134
3-ethyl-2-N,2-N-dimethyl-1-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pentane-1,2-diamine
CID 43101560
2-(2,3-dihydro-1H-inden-1-ylamino)-N,N-dimethylacetamide
CID 43215159
N-methyl-2,3-dihydro-1H-inden-1-amine;hydrochloride
CID 18627798
1-cyclopentyl-3-(2,3-dihydro-1H-inden-1-ylamino)propan-2-ol
CID 103157324
3-[[2-(dimethylamino)-4-methylpentyl]amino]-1,3-dihydroindol-2-one
CID 43207898
3-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-ylamino)butan-1-ol
CID 66091347

Frequently Asked Questions

What is the IUPAC name of 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine?
The IUPAC name of 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine (CID 43100770) is 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine.
What is the SMILES notation for 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine?
The canonical SMILES for 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine is CC(C)CC(CNC1CCc2ccccc21)N(C)C.
What is the InChIKey of 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine?
The InChIKey is FYPVMBJPUWRCJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2/c1-13(2)11-15(19(3)4)12-18-17-10-9-14-7-5-6-8-16(14)17/h5-8,13,15,17-18H,9-12H2,1-4H3.
What are the key properties of 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine?
1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine has a molecular weight of 260.43 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2,3-dihydro-1H-inden-1-yl)-2-N,2-N,4-trimethylpentane-1,2-diamine is sourced from PubChem (CID 43100770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).