N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide

C17H26N2O — CID 106893424

IUPACN-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESCC(C)CC(C)(CN)NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C17H26N2O/c1-12(2)10-17(3,11-18)19-16(20)15-8-13-6-4-5-7-14(13)9-15/h4-7,12,15H,8-11,18H2,1-3H3,(H,19,20)
InChIKeyPNOMTAFJQCCRDL-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.28
Rot. Bonds5

About N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide

N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide (PubChem CID 106893424) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide
PubChem CID106893424
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide
SMILESCC(C)CC(C)(CN)NC(=O)C1Cc2ccccc2C1
InChIInChI=1S/C17H26N2O/c1-12(2)10-17(3,11-18)19-16(20)15-8-13-6-4-5-7-14(13)9-15/h4-7,12,15H,8-11,18H2,1-3H3,(H,19,20)
InChIKeyPNOMTAFJQCCRDL-UHFFFAOYSA-N
XLogP2.28
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide?
The IUPAC name of N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide (CID 106893424) is N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide.
What is the SMILES notation for N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide?
The canonical SMILES for N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide is CC(C)CC(C)(CN)NC(=O)C1Cc2ccccc2C1.
What is the InChIKey of N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide?
The InChIKey is PNOMTAFJQCCRDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-12(2)10-17(3,11-18)19-16(20)15-8-13-6-4-5-7-14(13)9-15/h4-7,12,15H,8-11,18H2,1-3H3,(H,19,20).
What are the key properties of N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide?
N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide has a molecular weight of 274.41 g/mol, XLogP of 2.28, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2,4-dimethylpentan-2-yl)-2,3-dihydro-1H-indene-2-carboxamide is sourced from PubChem (CID 106893424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).