N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide

C14H20N2 — CID 65406240

IUPACN'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide
SMILESCC(C)(C)/N=C(\N)C1Cc2ccccc2C1
InChIInChI=1S/C14H20N2/c1-14(2,3)16-13(15)12-8-10-6-4-5-7-11(10)9-12/h4-7,12H,8-9H2,1-3H3,(H2,15,16)
InChIKeyHWSRFGHHXLMIDQ-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.56
Rot. Bonds1

About N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide

N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide (PubChem CID 65406240) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide.

Molecular Properties

Compound NameN'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide
PubChem CID65406240
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide
SMILESCC(C)(C)/N=C(\N)C1Cc2ccccc2C1
InChIInChI=1S/C14H20N2/c1-14(2,3)16-13(15)12-8-10-6-4-5-7-11(10)9-12/h4-7,12H,8-9H2,1-3H3,(H2,15,16)
InChIKeyHWSRFGHHXLMIDQ-UHFFFAOYSA-N
XLogP2.56
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-amino-N'-tert-butyl-2,3-dihydro-1-benzofuran-2-carboximidamide
CID 61360500
methane;2-methyl-2,3-dihydro-1H-indene
CID 142040721
N'-methylbicyclo[4.2.0]octa-1,3,5-triene-7-carboximidamide
CID 64985525
2-tert-butyl-2,3-dihydro-1H-indene;methane
CID 159665212
2,3-dihydro-1H-inden-2-amine;ethane
CID 142154792
3-tert-butyl-1,2,3,4-tetrahydroisoquinoline
CID 10487896
CID 174033948
CID 174033948
(3S)-2-tert-butyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
CID 70166082
1-(2,3-dihydro-1H-inden-2-yl)-3,4,4-trimethylpentan-1-one
CID 106893048
N-(1,3-dichloro-2-methylpropan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide
CID 106894284
disodium;2,3-dihydro-1H-indene-2-carboxylic acid;hydride
CID 173251406
O-(2,3-dihydro-1H-inden-2-yl)hydroxylamine
CID 68506766

Frequently Asked Questions

What is the IUPAC name of N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide?
The IUPAC name of N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide (CID 65406240) is N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide.
What is the SMILES notation for N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide?
The canonical SMILES for N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide is CC(C)(C)/N=C(\N)C1Cc2ccccc2C1.
What is the InChIKey of N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide?
The InChIKey is HWSRFGHHXLMIDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-14(2,3)16-13(15)12-8-10-6-4-5-7-11(10)9-12/h4-7,12H,8-9H2,1-3H3,(H2,15,16).
What are the key properties of N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide?
N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide has a molecular weight of 216.33 g/mol, XLogP of 2.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-tert-butyl-2,3-dihydro-1H-indene-2-carboximidamide is sourced from PubChem (CID 65406240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).