(6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

C20H32N6O — CID 129414575

IUPAC(6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESCc1cn2c(n1)CC[C@H](NCc1c(C(C)C)nn(C)c1N1CCOCC1)C2
InChIInChI=1S/C20H32N6O/c1-14(2)19-17(20(24(4)23-19)25-7-9-27-10-8-25)11-21-16-5-6-18-22-15(3)12-26(18)13-16/h12,14,16,21H,5-11,13H2,1-4H3/t16-/m0/s1
InChIKeyWMVPHFFTBHFUOQ-INIZCTEOSA-N
MW372.52 g/mol
LogP1.99
Rot. Bonds5

About (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine

(6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (PubChem CID 129414575) has the molecular formula C20H32N6O and a molecular weight of 372.52 g/mol. Its IUPAC name is (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name(6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
PubChem CID129414575
Molecular FormulaC20H32N6O
Molecular Weight372.52 g/mol
Exact Mass372.26
IUPAC Name(6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine
SMILESCc1cn2c(n1)CC[C@H](NCc1c(C(C)C)nn(C)c1N1CCOCC1)C2
InChIInChI=1S/C20H32N6O/c1-14(2)19-17(20(24(4)23-19)25-7-9-27-10-8-25)11-21-16-5-6-18-22-15(3)12-26(18)13-16/h12,14,16,21H,5-11,13H2,1-4H3/t16-/m0/s1
InChIKeyWMVPHFFTBHFUOQ-INIZCTEOSA-N
XLogP1.99
TPSA60.14 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.52
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The IUPAC name of (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine (CID 129414575) is (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is Cc1cn2c(n1)CC[C@H](NCc1c(C(C)C)nn(C)c1N1CCOCC1)C2.
What is the InChIKey of (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
The InChIKey is WMVPHFFTBHFUOQ-INIZCTEOSA-N. The full InChI is InChI=1S/C20H32N6O/c1-14(2)19-17(20(24(4)23-19)25-7-9-27-10-8-25)11-21-16-5-6-18-22-15(3)12-26(18)13-16/h12,14,16,21H,5-11,13H2,1-4H3/t16-/m0/s1.
What are the key properties of (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine?
(6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine has a molecular weight of 372.52 g/mol, XLogP of 1.99, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (6S)-2-methyl-N-[(1-methyl-5-morpholin-4-yl-3-propan-2-ylpyrazol-4-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 129414575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).