N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine

C18H22N2 — CID 50981740

IUPACN-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
SMILESCc1cccnc1CC(C)NC1Cc2ccccc2C1
InChIInChI=1S/C18H22N2/c1-13-6-5-9-19-18(13)10-14(2)20-17-11-15-7-3-4-8-16(15)12-17/h3-9,14,17,20H,10-12H2,1-2H3
InChIKeyJDFBIDKQCCAXQB-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.08
Rot. Bonds4

About N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine

N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine (PubChem CID 50981740) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine.

Molecular Properties

Compound NameN-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
PubChem CID50981740
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC NameN-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine
SMILESCc1cccnc1CC(C)NC1Cc2ccccc2C1
InChIInChI=1S/C18H22N2/c1-13-6-5-9-19-18(13)10-14(2)20-17-11-15-7-3-4-8-16(15)12-17/h3-9,14,17,20H,10-12H2,1-2H3
InChIKeyJDFBIDKQCCAXQB-UHFFFAOYSA-N
XLogP3.08
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The IUPAC name of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine (CID 50981740) is N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine.
What is the SMILES notation for N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The canonical SMILES for N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine is Cc1cccnc1CC(C)NC1Cc2ccccc2C1.
What is the InChIKey of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
The InChIKey is JDFBIDKQCCAXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-13-6-5-9-19-18(13)10-14(2)20-17-11-15-7-3-4-8-16(15)12-17/h3-9,14,17,20H,10-12H2,1-2H3.
What are the key properties of N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine?
N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine has a molecular weight of 266.39 g/mol, XLogP of 3.08, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-methyl-2-pyridinyl)propan-2-yl]-2,3-dihydro-1H-inden-2-amine is sourced from PubChem (CID 50981740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).