(4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine

C15H20N4 — CID 95778690

IUPAC(4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine
SMILESCCn1ncc2c1CCC[C@H]2NCc1ccccn1
InChIInChI=1S/C15H20N4/c1-2-19-15-8-5-7-14(13(15)11-18-19)17-10-12-6-3-4-9-16-12/h3-4,6,9,11,14,17H,2,5,7-8,10H2,1H3/t14-/m1/s1
InChIKeyGJJCCCLPQMWNHZ-CQSZACIVSA-N
MW256.35 g/mol
LogP2.47
Rot. Bonds4

About (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine

(4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine (PubChem CID 95778690) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine.

Molecular Properties

Compound Name(4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine
PubChem CID95778690
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name(4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine
SMILESCCn1ncc2c1CCC[C@H]2NCc1ccccn1
InChIInChI=1S/C15H20N4/c1-2-19-15-8-5-7-14(13(15)11-18-19)17-10-12-6-3-4-9-16-12/h3-4,6,9,11,14,17H,2,5,7-8,10H2,1H3/t14-/m1/s1
InChIKeyGJJCCCLPQMWNHZ-CQSZACIVSA-N
XLogP2.47
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4R)-N-[(2-tert-butyl-1,3-thiazol-5-yl)methyl]-1-ethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 95778624
(4S)-N-[(4-ethoxy-3-methoxyphenyl)methyl]-1-ethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 95778611
(4S)-N-[(3-ethoxy-4-methoxyphenyl)methyl]-1-ethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 95778561
(4R)-N-[(1-tert-butylpyrazol-4-yl)methyl]-1-ethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 95778646
(4R)-N-[(5-bromothiophen-3-yl)methyl]-1-ethyl-4,5,6,7-tetrahydroindazol-4-amine
CID 95778566
(4S)-1-ethyl-N-[(4-methoxy-3-propoxyphenyl)methyl]-4,5,6,7-tetrahydroindazol-4-amine
CID 95778587
1-ethyl-N-methyl-5,6,7,8-tetrahydro-4H-cyclohepta[d]pyrazol-4-amine
CID 107384385
N-ethyl-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-amine
CID 65356388
N-[(5-methyl-1H-pyrazol-3-yl)methyl]-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-amine
CID 45169911
N-ethyl-1-[(2-methylphenyl)methyl]-4,5,6,7-tetrahydroindazol-4-amine
CID 65356697
1-benzyl-N-[(1-methylpyrazol-4-yl)methyl]-4,5,6,7-tetrahydroindazol-4-amine
CID 86772207
N-benzyl-1-methyl-4,5,6,7-tetrahydroindazol-4-amine
CID 43247637

Frequently Asked Questions

What is the IUPAC name of (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine?
The IUPAC name of (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine (CID 95778690) is (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine.
What is the SMILES notation for (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine?
The canonical SMILES for (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine is CCn1ncc2c1CCC[C@H]2NCc1ccccn1.
What is the InChIKey of (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine?
The InChIKey is GJJCCCLPQMWNHZ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H20N4/c1-2-19-15-8-5-7-14(13(15)11-18-19)17-10-12-6-3-4-9-16-12/h3-4,6,9,11,14,17H,2,5,7-8,10H2,1H3/t14-/m1/s1.
What are the key properties of (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine?
(4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-ethyl-N-(pyridin-2-ylmethyl)-4,5,6,7-tetrahydroindazol-4-amine is sourced from PubChem (CID 95778690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).