N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide

C17H25N5O — CID 56645886

IUPACN-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide
SMILESCc1c2cccc(C(=O)NCCN(C)C)c2nn1C1CCNC1
InChIInChI=1S/C17H25N5O/c1-12-14-5-4-6-15(17(23)19-9-10-21(2)3)16(14)20-22(12)13-7-8-18-11-13/h4-6,13,18H,7-11H2,1-3H3,(H,19,23)
InChIKeyOPHQHIOAANHPOS-UHFFFAOYSA-N
MW315.42 g/mol
LogP1.17
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide

N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide (PubChem CID 56645886) has the molecular formula C17H25N5O and a molecular weight of 315.42 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide
PubChem CID56645886
Molecular FormulaC17H25N5O
Molecular Weight315.42 g/mol
Exact Mass315.21
IUPAC NameN-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide
SMILESCc1c2cccc(C(=O)NCCN(C)C)c2nn1C1CCNC1
InChIInChI=1S/C17H25N5O/c1-12-14-5-4-6-15(17(23)19-9-10-21(2)3)16(14)20-22(12)13-7-8-18-11-13/h4-6,13,18H,7-11H2,1-3H3,(H,19,23)
InChIKeyOPHQHIOAANHPOS-UHFFFAOYSA-N
XLogP1.17
TPSA62.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.42
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(dimethylamino)ethyl]-N-(3-methyl-2-piperidin-4-ylindazol-7-yl)formamide
CID 174677643
3-methyl-2-(4-methylpiperidin-3-yl)indazole-7-carboxamide
CID 56645469
N',N',3-trimethyl-2-pyrrolidin-2-ylindazole-7-carbohydrazide
CID 56645688
9-chloro-N-[2-(dimethylamino)ethyl]-5-methylacridine-4-carboxamide
CID 10593362
3-methyl-1-pyrrolidin-3-ylindazol-7-ol
CID 84682925
9-amino-N-[2-(dimethylamino)ethyl]-5-fluoroacridine-4-carboxamide
CID 1818
N-[2-(dimethylamino)ethyl]-6,7-dimethylacridine-4-carboxamide
CID 54432311
4-amino-N-[2-(dimethylamino)ethyl]naphthalene-1-carboxamide
CID 164662948
9-anilino-N-[2-(dimethylamino)ethyl]acridine-4-carboxamide
CID 59765054
N-[2-(dimethylamino)ethyl]-4-[[(3R)-pyrrolidin-3-yl]sulfamoyl]benzamide
CID 70720005
N-[(3S)-pyrrolidin-3-yl]naphthalene-1-carboxamide
CID 79689471
N-[2-(dimethylamino)ethyl]-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 62850406

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide (CID 56645886) is N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide is Cc1c2cccc(C(=O)NCCN(C)C)c2nn1C1CCNC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide?
The InChIKey is OPHQHIOAANHPOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N5O/c1-12-14-5-4-6-15(17(23)19-9-10-21(2)3)16(14)20-22(12)13-7-8-18-11-13/h4-6,13,18H,7-11H2,1-3H3,(H,19,23).
What are the key properties of N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide?
N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide has a molecular weight of 315.42 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-3-methyl-2-pyrrolidin-3-ylindazole-7-carboxamide is sourced from PubChem (CID 56645886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).