N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine

C19H26N2 — CID 66401248

IUPACN-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cccn1Cc1ccc2c(c1)CCC2
InChIInChI=1S/C19H26N2/c1-19(2,3)20-13-18-8-5-11-21(18)14-15-9-10-16-6-4-7-17(16)12-15/h5,8-12,20H,4,6-7,13-14H2,1-3H3
InChIKeyZZKAWFRRWZWELE-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.91
Rot. Bonds4

About N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine

N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 66401248) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID66401248
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC NameN-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cccn1Cc1ccc2c(c1)CCC2
InChIInChI=1S/C19H26N2/c1-19(2,3)20-13-18-8-5-11-21(18)14-15-9-10-16-6-4-7-17(16)12-15/h5,8-12,20H,4,6-7,13-14H2,1-3H3
InChIKeyZZKAWFRRWZWELE-UHFFFAOYSA-N
XLogP3.91
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine with MolForge

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Related Compounds

N-[[1-[(3,4-dichlorophenyl)methyl]pyrrol-2-yl]methyl]-2-methylpropan-2-amine
CID 66401437
N-[[1-[(3,4-difluorophenyl)methyl]pyrrol-2-yl]methyl]-2-methylpropan-2-amine
CID 82919681
N-[(1-ethylpyrrol-2-yl)methyl]-2,3-dihydro-1H-inden-5-amine
CID 66413645
N-[[1-[(1-ethylpyrazol-4-yl)methyl]pyrrol-2-yl]methyl]-2-methylpropan-2-amine
CID 66402997
N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)imidazol-2-yl]methyl]-2-methylpropan-1-amine
CID 66401707
2-methyl-N-[[1-(2-phenylethyl)pyrrol-2-yl]methyl]propan-2-amine
CID 66401243
2-methyl-N-[[1-[(3-methyl-2-pyridinyl)methyl]pyrrol-2-yl]methyl]propan-2-amine
CID 112651076
2-methyl-N-[(1-pentylpyrrol-2-yl)methyl]propan-2-amine
CID 66401427
2-methyl-N-[[1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]pyrrol-2-yl]methyl]propan-2-amine
CID 66402608
2-methyl-N-[(1-nonylpyrrol-2-yl)methyl]propan-2-amine
CID 66401049
2-[2-[(tert-butylamino)methyl]pyrrol-1-yl]-1-piperidin-1-ylethanone
CID 66402034
2-methyl-N-[[1-(4-phenylbutyl)pyrrol-2-yl]methyl]propan-2-amine
CID 114334303

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine (CID 66401248) is N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1cccn1Cc1ccc2c(c1)CCC2.
What is the InChIKey of N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is ZZKAWFRRWZWELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2/c1-19(2,3)20-13-18-8-5-11-21(18)14-15-9-10-16-6-4-7-17(16)12-15/h5,8-12,20H,4,6-7,13-14H2,1-3H3.
What are the key properties of N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine?
N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 282.43 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,3-dihydro-1H-inden-5-ylmethyl)pyrrol-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 66401248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).