N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine

C15H16N4O — CID 71974601

IUPACN-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine
SMILESCOc1ncccc1CNCc1cccc2cn[nH]c12
InChIInChI=1S/C15H16N4O/c1-20-15-13(6-3-7-17-15)9-16-8-11-4-2-5-12-10-18-19-14(11)12/h2-7,10,16H,8-9H2,1H3,(H,18,19)
InChIKeyRCMMONYHSRWVAS-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.26
Rot. Bonds5

About N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine

N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine (PubChem CID 71974601) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine.

Molecular Properties

Compound NameN-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine
PubChem CID71974601
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC NameN-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine
SMILESCOc1ncccc1CNCc1cccc2cn[nH]c12
InChIInChI=1S/C15H16N4O/c1-20-15-13(6-3-7-17-15)9-16-8-11-4-2-5-12-10-18-19-14(11)12/h2-7,10,16H,8-9H2,1H3,(H,18,19)
InChIKeyRCMMONYHSRWVAS-UHFFFAOYSA-N
XLogP2.26
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1H-indazol-7-ylmethyl)-2-methylpropan-1-amine
CID 115684234
1-(2,3-dimethoxyphenyl)-N-[(2-methoxy-3-pyridinyl)methyl]methanamine
CID 60761596
N-(1H-imidazol-5-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine
CID 62763558
1-(2-methoxy-3-pyridinyl)-N-[(2-methylpyrimidin-4-yl)methyl]methanamine
CID 62747167
1-(4-chlorophenyl)-N-[(2-methoxy-3-pyridinyl)methyl]methanamine
CID 54920418
2-[2-[[(2-methoxy-3-pyridinyl)methylamino]methyl]phenyl]acetic acid
CID 115461656
N-[(2-propan-2-yloxy-3-pyridinyl)methyl]-1H-indazole-7-carboxamide
CID 47057623
1-(2-methoxy-3-pyridinyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 114180399
1-(2-methoxy-3-pyridinyl)-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]methanamine
CID 107914372
(2S)-1-[(2-methoxy-3-pyridinyl)methylamino]propan-2-ol
CID 106931879
N-[(2-phenylmethoxy-3-pyridinyl)methyl]-1H-indazole-7-carboxamide
CID 47057730
N-[(3,5-dichlorophenyl)methyl]-1-(2-methoxy-3-pyridinyl)methanamine
CID 60859308

Frequently Asked Questions

What is the IUPAC name of N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine?
The IUPAC name of N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine (CID 71974601) is N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine.
What is the SMILES notation for N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine?
The canonical SMILES for N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine is COc1ncccc1CNCc1cccc2cn[nH]c12.
What is the InChIKey of N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine?
The InChIKey is RCMMONYHSRWVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-20-15-13(6-3-7-17-15)9-16-8-11-4-2-5-12-10-18-19-14(11)12/h2-7,10,16H,8-9H2,1H3,(H,18,19).
What are the key properties of N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine?
N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine has a molecular weight of 268.32 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indazol-7-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine is sourced from PubChem (CID 71974601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).