1-cyclopropyl-6-methyl-7-propan-2-ylindazole

C14H18N2 — CID 164840126

IUPAC1-cyclopropyl-6-methyl-7-propan-2-ylindazole
SMILESCc1ccc2cnn(C3CC3)c2c1C(C)C
InChIInChI=1S/C14H18N2/c1-9(2)13-10(3)4-5-11-8-15-16(14(11)13)12-6-7-12/h4-5,8-9,12H,6-7H2,1-3H3
InChIKeyNMNCEPMLXGWZHA-UHFFFAOYSA-N
MW214.31 g/mol
LogP3.80
Rot. Bonds2

About 1-cyclopropyl-6-methyl-7-propan-2-ylindazole

1-cyclopropyl-6-methyl-7-propan-2-ylindazole (PubChem CID 164840126) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 1-cyclopropyl-6-methyl-7-propan-2-ylindazole.

Molecular Properties

Compound Name1-cyclopropyl-6-methyl-7-propan-2-ylindazole
PubChem CID164840126
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name1-cyclopropyl-6-methyl-7-propan-2-ylindazole
SMILESCc1ccc2cnn(C3CC3)c2c1C(C)C
InChIInChI=1S/C14H18N2/c1-9(2)13-10(3)4-5-11-8-15-16(14(11)13)12-6-7-12/h4-5,8-9,12H,6-7H2,1-3H3
InChIKeyNMNCEPMLXGWZHA-UHFFFAOYSA-N
XLogP3.80
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclopropyl-4,5-dimethylpyrazole;ethane
CID 167523032
5,7-dimethyl-1-piperidin-4-ylindazole;hydrochloride
CID 134494617
[7-methoxy-1-(oxan-4-yl)indazol-6-yl]carbamic acid
CID 174225986
1-(3-methoxycyclobutyl)-7-propan-2-ylindazole
CID 168840414
1-cyclopropyl-5-(difluoromethyl)-4-propan-2-ylpyrazole
CID 169167177
4-bromo-5-chloro-1-cyclopropyl-7-methylindazole;ethane
CID 168927546
1-(4-methoxycyclohexyl)-5-methyl-4-propan-2-ylpyrazole
CID 176692261
1-cyclopropyl-4-methyl-5-(trifluoromethyl)pyrazole
CID 146515724
4-methyl-1-(4-methylcyclohexyl)pyrazol-5-amine
CID 43148156
2-cyclopentyl-N-propan-2-ylpyrazol-3-amine
CID 130683846
1-methyl-2,3,4-tri(propan-2-yl)benzene
CID 22369929
1-cyclopropyl-N-[5-(4-ethylpiperazin-1-yl)-4-methyl-2-pyridinyl]pyrazolo[4,5-h]quinazolin-8-amine
CID 164754275

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-6-methyl-7-propan-2-ylindazole?
The IUPAC name of 1-cyclopropyl-6-methyl-7-propan-2-ylindazole (CID 164840126) is 1-cyclopropyl-6-methyl-7-propan-2-ylindazole.
What is the SMILES notation for 1-cyclopropyl-6-methyl-7-propan-2-ylindazole?
The canonical SMILES for 1-cyclopropyl-6-methyl-7-propan-2-ylindazole is Cc1ccc2cnn(C3CC3)c2c1C(C)C.
What is the InChIKey of 1-cyclopropyl-6-methyl-7-propan-2-ylindazole?
The InChIKey is NMNCEPMLXGWZHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-9(2)13-10(3)4-5-11-8-15-16(14(11)13)12-6-7-12/h4-5,8-9,12H,6-7H2,1-3H3.
What are the key properties of 1-cyclopropyl-6-methyl-7-propan-2-ylindazole?
1-cyclopropyl-6-methyl-7-propan-2-ylindazole has a molecular weight of 214.31 g/mol, XLogP of 3.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-6-methyl-7-propan-2-ylindazole is sourced from PubChem (CID 164840126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).