5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine

C15H27N5 — CID 103056582

IUPAC5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine
SMILESCCCNc1cnc(CN2CCCC(N(C)C)C2)cn1
InChIInChI=1S/C15H27N5/c1-4-7-16-15-10-17-13(9-18-15)11-20-8-5-6-14(12-20)19(2)3/h9-10,14H,4-8,11-12H2,1-3H3,(H,16,18)
InChIKeyPTNSHVAKDQYBDT-UHFFFAOYSA-N
MW277.42 g/mol
LogP1.82
Rot. Bonds6

About 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine

5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine (PubChem CID 103056582) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine
PubChem CID103056582
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine
SMILESCCCNc1cnc(CN2CCCC(N(C)C)C2)cn1
InChIInChI=1S/C15H27N5/c1-4-7-16-15-10-17-13(9-18-15)11-20-8-5-6-14(12-20)19(2)3/h9-10,14H,4-8,11-12H2,1-3H3,(H,16,18)
InChIKeyPTNSHVAKDQYBDT-UHFFFAOYSA-N
XLogP1.82
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(3,4-dimethylpiperazin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103056437
5-[(4-propan-2-ylpiperidin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103502336
5-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propylpyrazin-2-amine
CID 103056605
N-propyl-5-[(3,4,5-trimethylpiperazin-1-yl)methyl]pyrazin-2-amine
CID 103056905
5-[(2,3-dimethylpiperidin-1-yl)methyl]-N-propylpyrazin-2-amine
CID 103055739
N-ethyl-5-[(3-propoxypiperidin-1-yl)methyl]pyrazin-2-amine
CID 103056216
6-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-ethylpyridin-2-amine
CID 79234659
2-[1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidin-4-yl]oxyethanol
CID 103056751
N-methyl-1-[[5-(propylamino)pyrazin-2-yl]methyl]piperidine-4-carboxamide
CID 103056085
N-ethyl-5-[(4-propylazepan-1-yl)methyl]pyrazin-2-amine
CID 103056522
N-ethyl-5-(piperidin-1-ylmethyl)pyrazin-2-amine
CID 103055450
1-[(2-chloro-1,3-thiazol-5-yl)methyl]-N,N-dimethylpiperidin-3-amine
CID 79764841

Frequently Asked Questions

What is the IUPAC name of 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine?
The IUPAC name of 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine (CID 103056582) is 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine.
What is the SMILES notation for 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine?
The canonical SMILES for 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine is CCCNc1cnc(CN2CCCC(N(C)C)C2)cn1.
What is the InChIKey of 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine?
The InChIKey is PTNSHVAKDQYBDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-4-7-16-15-10-17-13(9-18-15)11-20-8-5-6-14(12-20)19(2)3/h9-10,14H,4-8,11-12H2,1-3H3,(H,16,18).
What are the key properties of 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine?
5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine has a molecular weight of 277.42 g/mol, XLogP of 1.82, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[3-(dimethylamino)piperidin-1-yl]methyl]-N-propylpyrazin-2-amine is sourced from PubChem (CID 103056582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).