N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide

C14H18N2O — CID 80573936

IUPACN-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
SMILESO=C(CC1CNc2ccccc21)NCC1CC1
InChIInChI=1S/C14H18N2O/c17-14(16-8-10-5-6-10)7-11-9-15-13-4-2-1-3-12(11)13/h1-4,10-11,15H,5-9H2,(H,16,17)
InChIKeyKTJMVQISOVVMQB-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.11
Rot. Bonds4

About N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide

N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide (PubChem CID 80573936) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
PubChem CID80573936
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC NameN-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide
SMILESO=C(CC1CNc2ccccc21)NCC1CC1
InChIInChI=1S/C14H18N2O/c17-14(16-8-10-5-6-10)7-11-9-15-13-4-2-1-3-12(11)13/h1-4,10-11,15H,5-9H2,(H,16,17)
InChIKeyKTJMVQISOVVMQB-UHFFFAOYSA-N
XLogP2.11
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide (CID 80573936) is N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide is O=C(CC1CNc2ccccc21)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
The InChIKey is KTJMVQISOVVMQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c17-14(16-8-10-5-6-10)7-11-9-15-13-4-2-1-3-12(11)13/h1-4,10-11,15H,5-9H2,(H,16,17).
What are the key properties of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide?
N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide has a molecular weight of 230.31 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)acetamide is sourced from PubChem (CID 80573936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).