2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide

C13H20N4O — CID 119787806

IUPAC2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
SMILESO=C(CNCC1CC1)NC1CCCc2cn[nH]c21
InChIInChI=1S/C13H20N4O/c18-12(8-14-6-9-4-5-9)16-11-3-1-2-10-7-15-17-13(10)11/h7,9,11,14H,1-6,8H2,(H,15,17)(H,16,18)
InChIKeyCNICCCXMDSBFPO-UHFFFAOYSA-N
MW248.33 g/mol
LogP0.90
Rot. Bonds5

About 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide

2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide (PubChem CID 119787806) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
PubChem CID119787806
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
SMILESO=C(CNCC1CC1)NC1CCCc2cn[nH]c21
InChIInChI=1S/C13H20N4O/c18-12(8-14-6-9-4-5-9)16-11-3-1-2-10-7-15-17-13(10)11/h7,9,11,14H,1-6,8H2,(H,15,17)(H,16,18)
InChIKeyCNICCCXMDSBFPO-UHFFFAOYSA-N
XLogP0.90
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-(methylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)butanamide
CID 119787790
1-[4-(methoxymethyl)cyclohexyl]-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
CID 128727902
2-(3-fluorophenyl)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
CID 118740682
2-(3-ethylphenyl)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide
CID 154738802
3-amino-3-phenyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)propanamide;hydrochloride
CID 119951600
3-amino-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)cyclohexane-1-carboxamide
CID 119787796
1-phenyl-3-[(7S)-4,5,6,7-tetrahydro-1H-indazol-7-yl]urea
CID 97228997
N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrrolidine-3-carboxamide
CID 119787830
1-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)methyl]-3-(4,5,6,7-tetrahydro-1H-indazol-7-yl)urea
CID 154837315
1-cyclohexyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)pyrrolidine-3-carboxamide
CID 127500754
1-(4-cycloheptyloxybutyl)-3-[(7R)-4,5,6,7-tetrahydro-1H-indazol-7-yl]urea
CID 97231546
(2S)-2-amino-3-phenyl-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)propanamide
CID 119326065

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide (CID 119787806) is 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide is O=C(CNCC1CC1)NC1CCCc2cn[nH]c21.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide?
The InChIKey is CNICCCXMDSBFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c18-12(8-14-6-9-4-5-9)16-11-3-1-2-10-7-15-17-13(10)11/h7,9,11,14H,1-6,8H2,(H,15,17)(H,16,18).
What are the key properties of 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide?
2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide has a molecular weight of 248.33 g/mol, XLogP of 0.90, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-(4,5,6,7-tetrahydro-1H-indazol-7-yl)acetamide is sourced from PubChem (CID 119787806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).