N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide

C15H20N2O — CID 113084044

IUPACN-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide
SMILESCCC(=O)NCC(C)(C)c1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O/c1-4-14(18)17-10-15(2,3)12-9-16-13-8-6-5-7-11(12)13/h5-9,16H,4,10H2,1-3H3,(H,17,18)
InChIKeyWZPBPKJTJNNWTC-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.97
Rot. Bonds4

About N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide

N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide (PubChem CID 113084044) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide.

Molecular Properties

Compound NameN-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide
PubChem CID113084044
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide
SMILESCCC(=O)NCC(C)(C)c1c[nH]c2ccccc12
InChIInChI=1S/C15H20N2O/c1-4-14(18)17-10-15(2,3)12-9-16-13-8-6-5-7-11(12)13/h5-9,16H,4,10H2,1-3H3,(H,17,18)
InChIKeyWZPBPKJTJNNWTC-UHFFFAOYSA-N
XLogP2.97
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-amino-N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide
CID 115153153
[2-(1H-indol-3-yl)-2-methylpropyl]urea
CID 115168791
N-[2-(1H-indol-3-yl)-2-methylpropyl]-2-(4-methylphenyl)acetamide
CID 113084102
1-[2-(1H-indol-3-yl)-2-methylpropyl]-3-propan-2-ylurea
CID 113084112
2-(3-bromophenyl)-N-[2-(1H-indol-3-yl)-2-methylpropyl]acetamide
CID 113084108
2-[[2-(1H-indol-3-yl)-2-methylpropyl]amino]acetic acid
CID 115218163
N-[2-(1H-indol-3-yl)-2-methylpropyl]cyclohexanecarboxamide
CID 113084050
3-[1-(dimethylsulfamoylamino)-2-methylpropan-2-yl]-1H-indole
CID 113084118
N'-[2-(1H-indol-3-yl)-2-methylpropyl]ethane-1,2-diamine
CID 115195611
2-amino-3-[[2-(1H-indol-3-yl)-2-methylpropyl]amino]propan-1-ol
CID 115121040
N-[2-(5-fluoro-1H-indol-3-yl)-2-methylpropyl]-2-(3-fluorophenyl)acetamide
CID 113084215
2-(1H-indol-3-yl)-2-methylpropanedioic acid
CID 70075508

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide?
The IUPAC name of N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide (CID 113084044) is N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide.
What is the SMILES notation for N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide?
The canonical SMILES for N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide is CCC(=O)NCC(C)(C)c1c[nH]c2ccccc12.
What is the InChIKey of N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide?
The InChIKey is WZPBPKJTJNNWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-4-14(18)17-10-15(2,3)12-9-16-13-8-6-5-7-11(12)13/h5-9,16H,4,10H2,1-3H3,(H,17,18).
What are the key properties of N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide?
N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide has a molecular weight of 244.34 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-indol-3-yl)-2-methylpropyl]propanamide is sourced from PubChem (CID 113084044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).