N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine

C18H25N5 — CID 124944814

IUPACN-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
SMILESCNc1nccnc1C[C@@H]1CCCN(Cc2ccncc2C)C1
InChIInChI=1S/C18H25N5/c1-14-11-20-6-5-16(14)13-23-9-3-4-15(12-23)10-17-18(19-2)22-8-7-21-17/h5-8,11,15H,3-4,9-10,12-13H2,1-2H3,(H,19,22)/t15-/m0/s1
InChIKeyBMNYXRMRRQRHMT-HNNXBMFYSA-N
MW311.43 g/mol
LogP2.68
Rot. Bonds5

About N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine

N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine (PubChem CID 124944814) has the molecular formula C18H25N5 and a molecular weight of 311.43 g/mol. Its IUPAC name is N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
PubChem CID124944814
Molecular FormulaC18H25N5
Molecular Weight311.43 g/mol
Exact Mass311.21
IUPAC NameN-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
SMILESCNc1nccnc1C[C@@H]1CCCN(Cc2ccncc2C)C1
InChIInChI=1S/C18H25N5/c1-14-11-20-6-5-16(14)13-23-9-3-4-15(12-23)10-17-18(19-2)22-8-7-21-17/h5-8,11,15H,3-4,9-10,12-13H2,1-2H3,(H,19,22)/t15-/m0/s1
InChIKeyBMNYXRMRRQRHMT-HNNXBMFYSA-N
XLogP2.68
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.43
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

N-methyl-3-[[(3R)-1-(1H-pyrazol-5-ylmethyl)piperidin-3-yl]methyl]pyrazin-2-amine
CID 124988938
N-methyl-3-[[1-[(2-methylpyrazol-3-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 110113217
N-methyl-3-[[(3R)-1-[(1-methylpyrrol-2-yl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine
CID 124959550
N-methyl-3-[(1-pyrazin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095070
4-[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]pyrimidine
CID 124976907
N-methyl-3-[(1-pyrimidin-2-ylpiperidin-3-yl)methyl]pyrazin-2-amine
CID 110095069
N-[4-[1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]-2-pyridinyl]pyrazin-2-amine
CID 110111840
N-methyl-3-[[(3S)-3-pyrazin-2-ylpiperidin-1-yl]methyl]pyridin-2-amine
CID 95846016
3-[(1-ethylsulfonylpiperidin-3-yl)methyl]-N-methylpyrazin-2-amine
CID 110113242
2-[(3-methyl-4-pyridinyl)methyl]-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine
CID 114702040
1-[1-[(3-chloro-4-pyridinyl)methyl]piperidin-3-yl]-N-methylmethanamine;dihydrochloride
CID 119914421
(4,4-difluorocyclohexyl)-[3-[[3-(methylamino)pyrazin-2-yl]methyl]piperidin-1-yl]methanone
CID 110113321

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
The IUPAC name of N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine (CID 124944814) is N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine is CNc1nccnc1C[C@@H]1CCCN(Cc2ccncc2C)C1.
What is the InChIKey of N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
The InChIKey is BMNYXRMRRQRHMT-HNNXBMFYSA-N. The full InChI is InChI=1S/C18H25N5/c1-14-11-20-6-5-16(14)13-23-9-3-4-15(12-23)10-17-18(19-2)22-8-7-21-17/h5-8,11,15H,3-4,9-10,12-13H2,1-2H3,(H,19,22)/t15-/m0/s1.
What are the key properties of N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine?
N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine has a molecular weight of 311.43 g/mol, XLogP of 2.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-[[(3S)-1-[(3-methyl-4-pyridinyl)methyl]piperidin-3-yl]methyl]pyrazin-2-amine is sourced from PubChem (CID 124944814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).