N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine

C11H16N4O — CID 83837778

IUPACN-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
SMILESc1nc2c(c(NCC3CCCN3)n1)COC2
InChIInChI=1S/C11H16N4O/c1-2-8(12-3-1)4-13-11-9-5-16-6-10(9)14-7-15-11/h7-8,12H,1-6H2,(H,13,14,15)
InChIKeyODUQEOALNJLPRG-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.67
Rot. Bonds3

About N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine

N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine (PubChem CID 83837778) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
PubChem CID83837778
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC NameN-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine
SMILESc1nc2c(c(NCC3CCCN3)n1)COC2
InChIInChI=1S/C11H16N4O/c1-2-8(12-3-1)4-13-11-9-5-16-6-10(9)14-7-15-11/h7-8,12H,1-6H2,(H,13,14,15)
InChIKeyODUQEOALNJLPRG-UHFFFAOYSA-N
XLogP0.67
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-6-methyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 83838864
N-(piperidin-2-ylmethyl)-5,7-dihydrofuro[3,4-b]pyridin-2-amine
CID 83841237
4-(pyrrolidin-2-ylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 83848148
N-(pyrrolidin-2-ylmethyl)-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-2-amine
CID 83841695
N-(cyclohexylmethyl)-6,7,8,9-tetrahydro-5H-pyrimido[4,5-d]azepin-4-amine
CID 117102200
3-bromo-4-methyl-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 106876097
N-(cyclopropylmethyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4-amine
CID 117101707
N-ethyl-7,8-dihydro-5H-pyrano[4,3-d]pyrimidin-4-amine
CID 106472396
3-(piperidin-2-ylmethylamino)pyridazine-4-carbonitrile
CID 80515109
3-methoxy-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 83833834
6-methoxy-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine;hydrochloride
CID 66569768
6-chloro-N-(piperidin-2-ylmethyl)pyrimidin-4-amine
CID 71639840

Frequently Asked Questions

What is the IUPAC name of N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
The IUPAC name of N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine (CID 83837778) is N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine.
What is the SMILES notation for N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
The canonical SMILES for N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine is c1nc2c(c(NCC3CCCN3)n1)COC2.
What is the InChIKey of N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
The InChIKey is ODUQEOALNJLPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-2-8(12-3-1)4-13-11-9-5-16-6-10(9)14-7-15-11/h7-8,12H,1-6H2,(H,13,14,15).
What are the key properties of N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine?
N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine has a molecular weight of 220.28 g/mol, XLogP of 0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrrolidin-2-ylmethyl)-5,7-dihydrofuro[3,4-d]pyrimidin-4-amine is sourced from PubChem (CID 83837778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).