2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide

C14H18N4O — CID 82765921

IUPAC2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide
SMILESCC1(C(=O)Nc2ccc3[nH]ncc3c2)CCCC1N
InChIInChI=1S/C14H18N4O/c1-14(6-2-3-12(14)15)13(19)17-10-4-5-11-9(7-10)8-16-18-11/h4-5,7-8,12H,2-3,6,15H2,1H3,(H,16,18)(H,17,19)
InChIKeyUVYMGOTWUQFSAV-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.02
Rot. Bonds2

About 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide

2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide (PubChem CID 82765921) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide
PubChem CID82765921
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide
SMILESCC1(C(=O)Nc2ccc3[nH]ncc3c2)CCCC1N
InChIInChI=1S/C14H18N4O/c1-14(6-2-3-12(14)15)13(19)17-10-4-5-11-9(7-10)8-16-18-11/h4-5,7-8,12H,2-3,6,15H2,1H3,(H,16,18)(H,17,19)
InChIKeyUVYMGOTWUQFSAV-UHFFFAOYSA-N
XLogP2.02
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide (CID 82765921) is 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide is CC1(C(=O)Nc2ccc3[nH]ncc3c2)CCCC1N.
What is the InChIKey of 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide?
The InChIKey is UVYMGOTWUQFSAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-14(6-2-3-12(14)15)13(19)17-10-4-5-11-9(7-10)8-16-18-11/h4-5,7-8,12H,2-3,6,15H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide?
2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1H-indazol-5-yl)-1-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 82765921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).