1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide

C19H24N2O2 — CID 124854159

IUPAC1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide
SMILESO=C(NCC[C@H]1CCCO1)c1cc2ccccc2n1CC1CC1
InChIInChI=1S/C19H24N2O2/c22-19(20-10-9-16-5-3-11-23-16)18-12-15-4-1-2-6-17(15)21(18)13-14-7-8-14/h1-2,4,6,12,14,16H,3,5,7-11,13H2,(H,20,22)/t16-/m1/s1
InChIKeyWSQKUPAEUGRPPJ-MRXNPFEDSA-N
MW312.41 g/mol
LogP3.35
Rot. Bonds6

About 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide

1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide (PubChem CID 124854159) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide
PubChem CID124854159
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide
SMILESO=C(NCC[C@H]1CCCO1)c1cc2ccccc2n1CC1CC1
InChIInChI=1S/C19H24N2O2/c22-19(20-10-9-16-5-3-11-23-16)18-12-15-4-1-2-6-17(15)21(18)13-14-7-8-14/h1-2,4,6,12,14,16H,3,5,7-11,13H2,(H,20,22)/t16-/m1/s1
InChIKeyWSQKUPAEUGRPPJ-MRXNPFEDSA-N
XLogP3.35
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide?
The IUPAC name of 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide (CID 124854159) is 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide.
What is the SMILES notation for 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide?
The canonical SMILES for 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide is O=C(NCC[C@H]1CCCO1)c1cc2ccccc2n1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide?
The InChIKey is WSQKUPAEUGRPPJ-MRXNPFEDSA-N. The full InChI is InChI=1S/C19H24N2O2/c22-19(20-10-9-16-5-3-11-23-16)18-12-15-4-1-2-6-17(15)21(18)13-14-7-8-14/h1-2,4,6,12,14,16H,3,5,7-11,13H2,(H,20,22)/t16-/m1/s1.
What are the key properties of 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide?
1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide has a molecular weight of 312.41 g/mol, XLogP of 3.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-N-[2-[(2R)-oxolan-2-yl]ethyl]indole-2-carboxamide is sourced from PubChem (CID 124854159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).