N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine

C14H15N5 — CID 66164096

IUPACN-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine
SMILESc1cc2[nH]ncc2cc1NCc1cncn1C1CC1
InChIInChI=1S/C14H15N5/c1-4-14-10(6-17-18-14)5-11(1)16-8-13-7-15-9-19(13)12-2-3-12/h1,4-7,9,12,16H,2-3,8H2,(H,17,18)
InChIKeyRUGQMNTVTJJJMD-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.71
Rot. Bonds4

About N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine

N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine (PubChem CID 66164096) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine.

Molecular Properties

Compound NameN-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine
PubChem CID66164096
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC NameN-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine
SMILESc1cc2[nH]ncc2cc1NCc1cncn1C1CC1
InChIInChI=1S/C14H15N5/c1-4-14-10(6-17-18-14)5-11(1)16-8-13-7-15-9-19(13)12-2-3-12/h1,4-7,9,12,16H,2-3,8H2,(H,17,18)
InChIKeyRUGQMNTVTJJJMD-UHFFFAOYSA-N
XLogP2.71
TPSA58.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine?
The IUPAC name of N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine (CID 66164096) is N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine.
What is the SMILES notation for N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine?
The canonical SMILES for N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine is c1cc2[nH]ncc2cc1NCc1cncn1C1CC1.
What is the InChIKey of N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine?
The InChIKey is RUGQMNTVTJJJMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-4-14-10(6-17-18-14)5-11(1)16-8-13-7-15-9-19(13)12-2-3-12/h1,4-7,9,12,16H,2-3,8H2,(H,17,18).
What are the key properties of N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine?
N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine has a molecular weight of 253.31 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-cyclopropylimidazol-4-yl)methyl]-1H-indazol-5-amine is sourced from PubChem (CID 66164096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).