6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride

C6H9ClN4 — CID 166604055

IUPAC6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride
SMILESCl.Nc1ncc2c(n1)NCC2
InChIInChI=1S/C6H8N4.ClH/c7-6-9-3-4-1-2-8-5(4)10-6;/h3H,1-2H2,(H3,7,8,9,10);1H
InChIKeySNUUGHAOTGAJPV-UHFFFAOYSA-N
MW172.62 g/mol
LogP0.45
Rot. Bonds

About 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride

6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride (PubChem CID 166604055) has the molecular formula C6H9ClN4 and a molecular weight of 172.62 g/mol. Its IUPAC name is 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride.

Molecular Properties

Compound Name6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride
PubChem CID166604055
Molecular FormulaC6H9ClN4
Molecular Weight172.62 g/mol
Exact Mass172.05
IUPAC Name6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride
SMILESCl.Nc1ncc2c(n1)NCC2
InChIInChI=1S/C6H8N4.ClH/c7-6-9-3-4-1-2-8-5(4)10-6;/h3H,1-2H2,(H3,7,8,9,10);1H
InChIKeySNUUGHAOTGAJPV-UHFFFAOYSA-N
XLogP0.45
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.62
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine-2-carboxylate;hydrochloride
CID 170916820
2-benzyl-6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidine
CID 150185880
9-iodo-6,7-dihydro-5H-pyrimido[5,4-d][1]benzazepin-2-amine
CID 141303801
2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-5-ylmethanamine;dihydrochloride
CID 23000261
2-propan-2-yl-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine
CID 166941093
2-(methoxymethyl)-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine
CID 153425222
2,3,5,7,9-pentazatricyclo[6.3.1.04,12]dodeca-1(12),3,5,7-tetraen-6-amine
CID 154111959
2,3-dihydro-1H-pyrrolo[2,3-b]pyridine-6-carboxylic acid;hydrochloride
CID 154857231
5-(1,2,3,4-tetrahydroisoquinolin-6-yl)pyrimidine-2,4-diamine;hydrochloride
CID 175909095
5-[(5-propan-2-yl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridin-4-yl)oxy]pyrimidine-2,4-diamine
CID 155378627
2-(2-aminopyrimidin-4-yl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one;hydrochloride
CID 11300081
5,6-dihydropteridin-2-amine
CID 154124696

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride?
The IUPAC name of 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride (CID 166604055) is 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride.
What is the SMILES notation for 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride?
The canonical SMILES for 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride is Cl.Nc1ncc2c(n1)NCC2.
What is the InChIKey of 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride?
The InChIKey is SNUUGHAOTGAJPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4.ClH/c7-6-9-3-4-1-2-8-5(4)10-6;/h3H,1-2H2,(H3,7,8,9,10);1H.
What are the key properties of 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride?
6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride has a molecular weight of 172.62 g/mol, XLogP of 0.45, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-5H-pyrrolo[2,3-d]pyrimidin-2-amine;hydrochloride is sourced from PubChem (CID 166604055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).