6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine

C18H21N5O — CID 124959514

IUPAC6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine
SMILESCn1c(CN2CCO[C@@H](c3cccc(N)n3)C2)nc2ccccc21
InChIInChI=1S/C18H21N5O/c1-22-15-7-3-2-5-13(15)21-18(22)12-23-9-10-24-16(11-23)14-6-4-8-17(19)20-14/h2-8,16H,9-12H2,1H3,(H2,19,20)/t16-/m1/s1
InChIKeyGNVYKEVIALFEJT-MRXNPFEDSA-N
MW323.40 g/mol
LogP2.12
Rot. Bonds3

About 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine

6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine (PubChem CID 124959514) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine.

Molecular Properties

Compound Name6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine
PubChem CID124959514
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC Name6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine
SMILESCn1c(CN2CCO[C@@H](c3cccc(N)n3)C2)nc2ccccc21
InChIInChI=1S/C18H21N5O/c1-22-15-7-3-2-5-13(15)21-18(22)12-23-9-10-24-16(11-23)14-6-4-8-17(19)20-14/h2-8,16H,9-12H2,1H3,(H2,19,20)/t16-/m1/s1
InChIKeyGNVYKEVIALFEJT-MRXNPFEDSA-N
XLogP2.12
TPSA69.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyrazin-2-amine
CID 124959757
3-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyrazin-2-amine
CID 124959756
(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]-2-(4-methylpyrimidin-2-yl)morpholine
CID 124942629
(2R)-2-(5-ethyl-1H-1,2,4-triazol-3-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholine
CID 96997039
2-methyl-4-[(2S)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]-1H-pyrimidin-6-one
CID 137166499
4-[(1-methylbenzimidazol-2-yl)methyl]-2-(3-propan-2-yl-1H-1,2,4-triazol-5-yl)morpholine
CID 71928079
(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]-2-(3-propan-2-yl-1H-1,2,4-triazol-5-yl)morpholine
CID 96512374
6-[4-[(2-methylpyrazol-3-yl)methyl]morpholin-2-yl]pyridin-2-amine
CID 110112311
(2R)-2-(4-ethyl-1,2,4-triazol-3-yl)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholine
CID 129340570
6-[(2S)-4-(1,3-thiazol-2-ylmethyl)morpholin-2-yl]pyridin-2-amine
CID 125021683
6-[(2S)-4-[(5-fluoro-2-pyridinyl)methyl]morpholin-2-yl]pyridin-2-amine
CID 124983603
1-[(2S)-2-(6-amino-2-pyridinyl)morpholin-4-yl]-2-(2-methylbenzimidazol-1-yl)ethanone
CID 125019995

Frequently Asked Questions

What is the IUPAC name of 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine?
The IUPAC name of 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine (CID 124959514) is 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine.
What is the SMILES notation for 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine?
The canonical SMILES for 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine is Cn1c(CN2CCO[C@@H](c3cccc(N)n3)C2)nc2ccccc21.
What is the InChIKey of 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine?
The InChIKey is GNVYKEVIALFEJT-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H21N5O/c1-22-15-7-3-2-5-13(15)21-18(22)12-23-9-10-24-16(11-23)14-6-4-8-17(19)20-14/h2-8,16H,9-12H2,1H3,(H2,19,20)/t16-/m1/s1.
What are the key properties of 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine?
6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine has a molecular weight of 323.40 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2R)-4-[(1-methylbenzimidazol-2-yl)methyl]morpholin-2-yl]pyridin-2-amine is sourced from PubChem (CID 124959514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).