6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine

C11H21N7 — CID 63637130

IUPAC6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine
SMILESCCN(Cc1nc(N)nc(N)n1)C1CCCNC1
InChIInChI=1S/C11H21N7/c1-2-18(8-4-3-5-14-6-8)7-9-15-10(12)17-11(13)16-9/h8,14H,2-7H2,1H3,(H4,12,13,15,16,17)
InChIKeyYRXNGFNRXNVJPH-UHFFFAOYSA-N
MW251.34 g/mol
LogP-0.39
Rot. Bonds4

About 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine

6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine (PubChem CID 63637130) has the molecular formula C11H21N7 and a molecular weight of 251.34 g/mol. Its IUPAC name is 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine
PubChem CID63637130
Molecular FormulaC11H21N7
Molecular Weight251.34 g/mol
Exact Mass251.19
IUPAC Name6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine
SMILESCCN(Cc1nc(N)nc(N)n1)C1CCCNC1
InChIInChI=1S/C11H21N7/c1-2-18(8-4-3-5-14-6-8)7-9-15-10(12)17-11(13)16-9/h8,14H,2-7H2,1H3,(H4,12,13,15,16,17)
InChIKeyYRXNGFNRXNVJPH-UHFFFAOYSA-N
XLogP-0.39
TPSA105.98 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 5-0.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

6-[[ethyl(pyrrolidin-3-yl)amino]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 63300392
N-ethyl-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidin-3-amine
CID 63636269
4-[[ethyl(piperidin-3-yl)amino]methyl]phenol
CID 63643977
N-ethyl-N-[(3,4,5-trifluorophenyl)methyl]piperidin-3-amine
CID 63636373
N-ethyl-N-[(3-ethylimidazol-4-yl)methyl]piperidin-3-amine
CID 66135560
N-ethyl-N-propylpiperidin-3-amine
CID 43317075
N-[(5-bromothiophen-3-yl)methyl]-N-ethylpiperidin-3-amine
CID 63638010
N-[(2,6-dichlorophenyl)methyl]-N-ethylpiperidin-3-amine
CID 63643457
N-but-2-enyl-N-ethylpiperidin-3-amine
CID 77002860
N-but-2-ynyl-N-ethylpiperidin-3-amine
CID 63636615
6-[[(4-aminocyclohexyl)-ethylamino]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 79112881
(3S)-N,N-diethylpyrrolidin-3-amine
CID 30722524

Frequently Asked Questions

What is the IUPAC name of 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine (CID 63637130) is 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine is CCN(Cc1nc(N)nc(N)n1)C1CCCNC1.
What is the InChIKey of 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine?
The InChIKey is YRXNGFNRXNVJPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N7/c1-2-18(8-4-3-5-14-6-8)7-9-15-10(12)17-11(13)16-9/h8,14H,2-7H2,1H3,(H4,12,13,15,16,17).
What are the key properties of 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine?
6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine has a molecular weight of 251.34 g/mol, XLogP of -0.39, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[ethyl(piperidin-3-yl)amino]methyl]-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 63637130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).