(7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

C15H23N3O2 — CID 164637009

IUPAC(7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCc1ncc2n1CC[C@H](C(=O)N(C)CC1(O)CCC1)C2
InChIInChI=1S/C15H23N3O2/c1-11-16-9-13-8-12(4-7-18(11)13)14(19)17(2)10-15(20)5-3-6-15/h9,12,20H,3-8,10H2,1-2H3/t12-/m0/s1
InChIKeyOJKTXGLANCRPDP-LBPRGKRZSA-N
MW277.37 g/mol
LogP1.13
Rot. Bonds3

About (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide

(7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (PubChem CID 164637009) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.

Molecular Properties

Compound Name(7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
PubChem CID164637009
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name(7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide
SMILESCc1ncc2n1CC[C@H](C(=O)N(C)CC1(O)CCC1)C2
InChIInChI=1S/C15H23N3O2/c1-11-16-9-13-8-12(4-7-18(11)13)14(19)17(2)10-15(20)5-3-6-15/h9,12,20H,3-8,10H2,1-2H3/t12-/m0/s1
InChIKeyOJKTXGLANCRPDP-LBPRGKRZSA-N
XLogP1.13
TPSA58.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The IUPAC name of (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide (CID 164637009) is (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide.
What is the SMILES notation for (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The canonical SMILES for (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is Cc1ncc2n1CC[C@H](C(=O)N(C)CC1(O)CCC1)C2.
What is the InChIKey of (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
The InChIKey is OJKTXGLANCRPDP-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-11-16-9-13-8-12(4-7-18(11)13)14(19)17(2)10-15(20)5-3-6-15/h9,12,20H,3-8,10H2,1-2H3/t12-/m0/s1.
What are the key properties of (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide?
(7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7S)-N-[(1-hydroxycyclobutyl)methyl]-N,3-dimethyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-7-carboxamide is sourced from PubChem (CID 164637009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).