N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine

C19H22N6O — CID 125018681

IUPACN-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine
SMILESCc1cccnc1Nc1ccc([C@H]2CN(Cc3ncc[nH]3)CCO2)nc1
InChIInChI=1S/C19H22N6O/c1-14-3-2-6-22-19(14)24-15-4-5-16(23-11-15)17-12-25(9-10-26-17)13-18-20-7-8-21-18/h2-8,11,17H,9-10,12-13H2,1H3,(H,20,21)(H,22,24)/t17-/m1/s1
InChIKeyXQPQFYKDNFNMQG-QGZVFWFLSA-N
MW350.43 g/mol
LogP2.83
Rot. Bonds5

About N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine

N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine (PubChem CID 125018681) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine.

Molecular Properties

Compound NameN-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine
PubChem CID125018681
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC NameN-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine
SMILESCc1cccnc1Nc1ccc([C@H]2CN(Cc3ncc[nH]3)CCO2)nc1
InChIInChI=1S/C19H22N6O/c1-14-3-2-6-22-19(14)24-15-4-5-16(23-11-15)17-12-25(9-10-26-17)13-18-20-7-8-21-18/h2-8,11,17H,9-10,12-13H2,1H3,(H,20,21)(H,22,24)/t17-/m1/s1
InChIKeyXQPQFYKDNFNMQG-QGZVFWFLSA-N
XLogP2.83
TPSA78.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine?
The IUPAC name of N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine (CID 125018681) is N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine.
What is the SMILES notation for N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine?
The canonical SMILES for N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine is Cc1cccnc1Nc1ccc([C@H]2CN(Cc3ncc[nH]3)CCO2)nc1.
What is the InChIKey of N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine?
The InChIKey is XQPQFYKDNFNMQG-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H22N6O/c1-14-3-2-6-22-19(14)24-15-4-5-16(23-11-15)17-12-25(9-10-26-17)13-18-20-7-8-21-18/h2-8,11,17H,9-10,12-13H2,1H3,(H,20,21)(H,22,24)/t17-/m1/s1.
What are the key properties of N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine?
N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine has a molecular weight of 350.43 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(2R)-4-(1H-imidazol-2-ylmethyl)morpholin-2-yl]-3-pyridinyl]-3-methylpyridin-2-amine is sourced from PubChem (CID 125018681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).