[1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine

C13H21N5 — CID 103278796

IUPAC[1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine
SMILESNCC1CCCN(c2ncc3c(n2)CCNC3)C1
InChIInChI=1S/C13H21N5/c14-6-10-2-1-5-18(9-10)13-16-8-11-7-15-4-3-12(11)17-13/h8,10,15H,1-7,9,14H2
InChIKeyFPQOJPNICAJBDZ-UHFFFAOYSA-N
MW247.35 g/mol
LogP0.30
Rot. Bonds2

About [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine

[1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine (PubChem CID 103278796) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine
PubChem CID103278796
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name[1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine
SMILESNCC1CCCN(c2ncc3c(n2)CCNC3)C1
InChIInChI=1S/C13H21N5/c14-6-10-2-1-5-18(9-10)13-16-8-11-7-15-4-3-12(11)17-13/h8,10,15H,1-7,9,14H2
InChIKeyFPQOJPNICAJBDZ-UHFFFAOYSA-N
XLogP0.30
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 50.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[1-(6-propan-2-yl-5,6,7,8-tetrahydroquinazolin-2-yl)piperidin-3-yl]methanamine
CID 103278777
[1-(7,8-dimethyl-5,6,7,8-tetrahydroquinazolin-2-yl)piperidin-3-yl]methanamine
CID 103278800
[1-(5,8-dimethyl-5,6,7,8-tetrahydroquinazolin-2-yl)piperidin-3-yl]methanamine
CID 103278789
[1-(5-ethyl-4-propylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 103278793
[1-(4-ethyl-5-methylpyrimidin-2-yl)piperidin-3-yl]methanamine
CID 103278831
2-pyrrolidin-1-yl-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepine
CID 105473150
2-[3-[[1-(5-ethylpyrimidin-2-yl)piperidin-4-yl]methoxy]pyrrolidin-1-yl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 143852541
2-(1-methylpiperidin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 115039114
[1-[5-(1H-pyrrol-3-yl)pyrimidin-2-yl]piperidin-3-yl]methanamine
CID 116976207
2-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazolin-6-amine
CID 86263335
2-cyclopentyl-1-[(3S)-3-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-1-yl]ethanone
CID 92567837
[1-[4-(1-ethylpyrazol-4-yl)pyrimidin-2-yl]piperidin-3-yl]methanamine
CID 103278754

Frequently Asked Questions

What is the IUPAC name of [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine?
The IUPAC name of [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine (CID 103278796) is [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine.
What is the SMILES notation for [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine?
The canonical SMILES for [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine is NCC1CCCN(c2ncc3c(n2)CCNC3)C1.
What is the InChIKey of [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine?
The InChIKey is FPQOJPNICAJBDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c14-6-10-2-1-5-18(9-10)13-16-8-11-7-15-4-3-12(11)17-13/h8,10,15H,1-7,9,14H2.
What are the key properties of [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine?
[1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine has a molecular weight of 247.35 g/mol, XLogP of 0.30, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)piperidin-3-yl]methanamine is sourced from PubChem (CID 103278796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).