2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine

C19H27N — CID 154499995

IUPAC2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine
SMILESCC1=CC=CC1c1ccccc1C(C)(C)NC(C)(C)C
InChIInChI=1S/C19H27N/c1-14-10-9-12-15(14)16-11-7-8-13-17(16)19(5,6)20-18(2,3)4/h7-13,15,20H,1-6H3
InChIKeyKQFQPJTYGHAGKM-UHFFFAOYSA-N
MW269.43 g/mol
LogP4.91
Rot. Bonds3

About 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine

2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine (PubChem CID 154499995) has the molecular formula C19H27N and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine
PubChem CID154499995
Molecular FormulaC19H27N
Molecular Weight269.43 g/mol
Exact Mass269.21
IUPAC Name2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine
SMILESCC1=CC=CC1c1ccccc1C(C)(C)NC(C)(C)C
InChIInChI=1S/C19H27N/c1-14-10-9-12-15(14)16-11-7-8-13-17(16)19(5,6)20-18(2,3)4/h7-13,15,20H,1-6H3
InChIKeyKQFQPJTYGHAGKM-UHFFFAOYSA-N
XLogP4.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine with MolForge

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Related Compounds

2-methyl-N-[2-[2-(2-phenyl-1H-inden-1-yl)phenyl]propan-2-yl]propan-2-amine
CID 23014756
[4-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]phenyl]methanol
CID 175240515
N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine
CID 141067325
2-[2-(2-methylcyclopenta-2,4-dien-1-yl)naphthalen-1-yl]propan-2-ol;titanium(2+);dichloride
CID 160957887
1-methoxy-2-(2-methylcyclopenta-2,4-dien-1-yl)naphthalene
CID 174460458
(1S,8R)-13-methylidenetricyclo[6.4.1.02,7]trideca-2,4,6,9,11-pentaene
CID 95564771
5-[2-[(tert-butylhydrazinylidene)methyl]phenyl]-N,N-dimethylcyclopenta-1,3-dien-1-amine
CID 141067018
4,9-dimethyl-4a,9a-dihydrocarbazole
CID 144920089
10-methyl-8-oxatricyclo[7.4.1.02,7]tetradeca-2,4,6,10,12-pentaene
CID 143232100
2-[2-(1H-inden-1-yl)phenyl]propan-2-yl-phenylazanide;titanium(3+);dichloride
CID 87501421
1,5-dimethyl-4aH-benzo[7]annulene
CID 91554041
5-(2,2-dimethylpropyl)-1-methylcyclopenta-1,3-diene
CID 23678565

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine?
The IUPAC name of 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine (CID 154499995) is 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine is CC1=CC=CC1c1ccccc1C(C)(C)NC(C)(C)C.
What is the InChIKey of 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine?
The InChIKey is KQFQPJTYGHAGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N/c1-14-10-9-12-15(14)16-11-7-8-13-17(16)19(5,6)20-18(2,3)4/h7-13,15,20H,1-6H3.
What are the key properties of 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine?
2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine has a molecular weight of 269.43 g/mol, XLogP of 4.91, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine is sourced from PubChem (CID 154499995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).