N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide

C19H21N5O2 — CID 135234954

IUPACN-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide
SMILESCn1cc(C2CCCN(C(=O)c3ccn[nH]3)C2)c2cc(NC=O)ccc21
InChIInChI=1S/C19H21N5O2/c1-23-11-16(15-9-14(20-12-25)4-5-18(15)23)13-3-2-8-24(10-13)19(26)17-6-7-21-22-17/h4-7,9,11-13H,2-3,8,10H2,1H3,(H,20,25)(H,21,22)
InChIKeyVXTGIRYVTSJPOC-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.49
Rot. Bonds4

About N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide

N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide (PubChem CID 135234954) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide.

Molecular Properties

Compound NameN-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide
PubChem CID135234954
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC NameN-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide
SMILESCn1cc(C2CCCN(C(=O)c3ccn[nH]3)C2)c2cc(NC=O)ccc21
InChIInChI=1S/C19H21N5O2/c1-23-11-16(15-9-14(20-12-25)4-5-18(15)23)13-3-2-8-24(10-13)19(26)17-6-7-21-22-17/h4-7,9,11-13H,2-3,8,10H2,1H3,(H,20,25)(H,21,22)
InChIKeyVXTGIRYVTSJPOC-UHFFFAOYSA-N
XLogP2.49
TPSA83.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[3-(methylamino)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 63080160
(1-methylindol-3-yl)-[(3R)-3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 124605867
[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 56741838
[(3S)-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 97313996
[3-(1,3-dimethylpyrazolo[5,4-b]pyridin-6-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 110118587
[3-(4,8-dimethyl-6,7-dihydro-5H-pyrido[2,3-d]pyrimidin-2-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 110268686
[(3S)-3-(3-bromoanilino)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 125139715
[3-[4-methyl-5-(piperidin-1-ylmethyl)-1,2,4-triazol-3-yl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 70763208
[3-[4-methyl-5-(piperidine-1-carbonyl)pyrimidin-2-yl]piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 110248102
(2-methylpyrazol-3-yl)-[3-(1H-pyrazol-5-yl)piperidin-1-yl]methanone
CID 110271023
[(3R)-3-(3-amino-2H-pyrazolo[3,4-b]pyridin-6-yl)piperidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 125017315
[(3S)-3-hydroxypyrrolidin-1-yl]-(1H-pyrazol-5-yl)methanone
CID 79029409

Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide?
The IUPAC name of N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide (CID 135234954) is N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide.
What is the SMILES notation for N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide?
The canonical SMILES for N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide is Cn1cc(C2CCCN(C(=O)c3ccn[nH]3)C2)c2cc(NC=O)ccc21.
What is the InChIKey of N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide?
The InChIKey is VXTGIRYVTSJPOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-23-11-16(15-9-14(20-12-25)4-5-18(15)23)13-3-2-8-24(10-13)19(26)17-6-7-21-22-17/h4-7,9,11-13H,2-3,8,10H2,1H3,(H,20,25)(H,21,22).
What are the key properties of N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide?
N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide has a molecular weight of 351.41 g/mol, XLogP of 2.49, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-3-[1-(1H-pyrazole-5-carbonyl)piperidin-3-yl]indol-5-yl]formamide is sourced from PubChem (CID 135234954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).