(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide

C21H29N3O3 — CID 92503700

IUPAC(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide
SMILESCCCNC(=O)[C@H](C)C1CCN(C(=O)c2cc3ccc(OC)cc3[nH]2)CC1
InChIInChI=1S/C21H29N3O3/c1-4-9-22-20(25)14(2)15-7-10-24(11-8-15)21(26)19-12-16-5-6-17(27-3)13-18(16)23-19/h5-6,12-15,23H,4,7-11H2,1-3H3,(H,22,25)/t14-/m1/s1
InChIKeyLRGRFFIVPNLMKZ-CQSZACIVSA-N
MW371.48 g/mol
LogP3.19
Rot. Bonds6

About (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide

(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide (PubChem CID 92503700) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide.

Molecular Properties

Compound Name(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide
PubChem CID92503700
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC Name(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide
SMILESCCCNC(=O)[C@H](C)C1CCN(C(=O)c2cc3ccc(OC)cc3[nH]2)CC1
InChIInChI=1S/C21H29N3O3/c1-4-9-22-20(25)14(2)15-7-10-24(11-8-15)21(26)19-12-16-5-6-17(27-3)13-18(16)23-19/h5-6,12-15,23H,4,7-11H2,1-3H3,(H,22,25)/t14-/m1/s1
InChIKeyLRGRFFIVPNLMKZ-CQSZACIVSA-N
XLogP3.19
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-(3-methylbutyl)propanamide
CID 92503706
(2S)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 92503758
(2S)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-[3-(4-methylpiperazin-1-yl)propyl]propanamide
CID 92765247
(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-(3-piperidin-1-ylpropyl)propanamide
CID 92503749
(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-(3-morpholin-4-ylpropyl)propanamide
CID 92503701
(2R)-N-cyclohexyl-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide
CID 92503737
2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-[3-(2-methylpiperidin-1-yl)propyl]propanamide
CID 20971114
(2R)-N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide
CID 92503741
(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)propanamide
CID 92895153
(2S)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-[(2S)-4-phenylbutan-2-yl]propanamide
CID 92503728
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]propanamide
CID 92503745
N-butyl-2-[1-(1H-indole-2-carbonyl)piperidin-4-yl]propanamide
CID 50816867

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide?
The IUPAC name of (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide (CID 92503700) is (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide.
What is the SMILES notation for (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide?
The canonical SMILES for (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide is CCCNC(=O)[C@H](C)C1CCN(C(=O)c2cc3ccc(OC)cc3[nH]2)CC1.
What is the InChIKey of (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide?
The InChIKey is LRGRFFIVPNLMKZ-CQSZACIVSA-N. The full InChI is InChI=1S/C21H29N3O3/c1-4-9-22-20(25)14(2)15-7-10-24(11-8-15)21(26)19-12-16-5-6-17(27-3)13-18(16)23-19/h5-6,12-15,23H,4,7-11H2,1-3H3,(H,22,25)/t14-/m1/s1.
What are the key properties of (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide?
(2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide has a molecular weight of 371.48 g/mol, XLogP of 3.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[1-(6-methoxy-1H-indole-2-carbonyl)piperidin-4-yl]-N-propylpropanamide is sourced from PubChem (CID 92503700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).