1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol

C20H25N5O — CID 170352169

IUPAC1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol
SMILESNc1nccc(-c2ccc3[nH]nc(N)c3c2)c1CCC1(O)CCCCC1
InChIInChI=1S/C20H25N5O/c21-18-15(6-10-20(26)8-2-1-3-9-20)14(7-11-23-18)13-4-5-17-16(12-13)19(22)25-24-17/h4-5,7,11-12,26H,1-3,6,8-10H2,(H2,21,23)(H3,22,24,25)
InChIKeyOEEPNTXILVQMDG-UHFFFAOYSA-N
MW351.45 g/mol
LogP3.42
Rot. Bonds4

About 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol

1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol (PubChem CID 170352169) has the molecular formula C20H25N5O and a molecular weight of 351.45 g/mol. Its IUPAC name is 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol.

Molecular Properties

Compound Name1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol
PubChem CID170352169
Molecular FormulaC20H25N5O
Molecular Weight351.45 g/mol
Exact Mass351.21
IUPAC Name1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol
SMILESNc1nccc(-c2ccc3[nH]nc(N)c3c2)c1CCC1(O)CCCCC1
InChIInChI=1S/C20H25N5O/c21-18-15(6-10-20(26)8-2-1-3-9-20)14(7-11-23-18)13-4-5-17-16(12-13)19(22)25-24-17/h4-5,7,11-12,26H,1-3,6,8-10H2,(H2,21,23)(H3,22,24,25)
InChIKeyOEEPNTXILVQMDG-UHFFFAOYSA-N
XLogP3.42
TPSA113.84 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 53.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

5-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]-1-morpholin-4-ylpent-4-yn-1-one
CID 170351850
5-[2-[3-(2-phenylethyl)phenyl]-1H-pyrrolo[2,3-b]pyridin-4-yl]-1H-indazol-3-amine
CID 172570945
5-(4-methyl-1H-indazol-5-yl)-1H-indazol-3-amine
CID 142763266
5-(2-propan-2-yl-4-pyridinyl)-1H-indazol-3-amine
CID 58588585
5-[2-(propan-2-ylamino)-4-pyridinyl]-1H-indazol-3-amine
CID 170352224
5-(2-methoxy-3-pyridinyl)-1H-indazol-3-amine
CID 68739130
2-[2-(3-amino-1H-indazol-5-yl)phenoxy]acetohydrazide
CID 11565619
5-[2-(2-pyridin-4-ylethylamino)-4-pyridinyl]-1H-indazol-3-amine
CID 172571058
4-(3-amino-1H-indazol-5-yl)-N-[3-(dimethylamino)propyl]-1H-pyrrolo[2,3-b]pyridine-2-carboxamide
CID 170351912
5-[2-(benzylamino)-4-pyridinyl]-1H-indazol-3-amine
CID 172571090
5-pyridin-3-yl-1H-indazol-3-amine
CID 59023862
5-[2-(4-phenylmethoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-4-yl]-1H-indazol-3-amine
CID 172570832

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol?
The IUPAC name of 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol (CID 170352169) is 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol.
What is the SMILES notation for 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol?
The canonical SMILES for 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol is Nc1nccc(-c2ccc3[nH]nc(N)c3c2)c1CCC1(O)CCCCC1.
What is the InChIKey of 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol?
The InChIKey is OEEPNTXILVQMDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O/c21-18-15(6-10-20(26)8-2-1-3-9-20)14(7-11-23-18)13-4-5-17-16(12-13)19(22)25-24-17/h4-5,7,11-12,26H,1-3,6,8-10H2,(H2,21,23)(H3,22,24,25).
What are the key properties of 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol?
1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol has a molecular weight of 351.45 g/mol, XLogP of 3.42, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-amino-4-(3-amino-1H-indazol-5-yl)-3-pyridinyl]ethyl]cyclohexan-1-ol is sourced from PubChem (CID 170352169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).