2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine

C14H17ClN4O2 — CID 166164483

IUPAC2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine
SMILESClc1nc(N2CCOCC2)c2oc(C3CCNC3)cc2n1
InChIInChI=1S/C14H17ClN4O2/c15-14-17-10-7-11(9-1-2-16-8-9)21-12(10)13(18-14)19-3-5-20-6-4-19/h7,9,16H,1-6,8H2
InChIKeyQKWTUBYYXUWWCN-UHFFFAOYSA-N
MW308.77 g/mol
LogP1.79
Rot. Bonds2

About 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine

2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine (PubChem CID 166164483) has the molecular formula C14H17ClN4O2 and a molecular weight of 308.77 g/mol. Its IUPAC name is 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine.

Molecular Properties

Compound Name2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine
PubChem CID166164483
Molecular FormulaC14H17ClN4O2
Molecular Weight308.77 g/mol
Exact Mass308.10
IUPAC Name2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine
SMILESClc1nc(N2CCOCC2)c2oc(C3CCNC3)cc2n1
InChIInChI=1S/C14H17ClN4O2/c15-14-17-10-7-11(9-1-2-16-8-9)21-12(10)13(18-14)19-3-5-20-6-4-19/h7,9,16H,1-6,8H2
InChIKeyQKWTUBYYXUWWCN-UHFFFAOYSA-N
XLogP1.79
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.77
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidine-6-carboxamide
CID 86618417
4-[6-[azetidin-2-yl(piperidin-1-yl)methyl]-2-chlorothieno[3,2-d]pyrimidin-4-yl]morpholine
CID 87185652
4-(2-chloro-4-morpholin-4-ylpyrido[3,2-d]pyrimidin-7-yl)morpholine
CID 168922552
2-chloro-4-morpholin-4-ylquinazolin-7-ol
CID 137308981
4-(2-bromo-4-pyrrolidin-3-ylphenyl)morpholine
CID 117496111
4-[2-chloro-6-(chloromethyl)thieno[3,2-d]pyrimidin-4-yl]morpholine
CID 66553795
4-(2-chloro-6-iodo-5-methylpyrrolo[3,2-d]pyrimidin-4-yl)morpholine
CID 166155958
CID 166164666
CID 166164666
4-[(2-chloro-4-pyrrolidin-3-ylphenyl)methyl]morpholine
CID 117450927
tert-butyl 5-(2-chloro-4-morpholin-4-ylfuro[3,2-d]pyrimidin-6-yl)-3-methylpyrazole-1-carboxylate
CID 166164494
12-bromo-4-chloro-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-chloro-6,12-dimorpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;morpholine
CID 161359604
4-(2-chloro-9-methyl-8-piperidin-4-yloxypurin-6-yl)morpholine
CID 122502463

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine?
The IUPAC name of 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine (CID 166164483) is 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine.
What is the SMILES notation for 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine?
The canonical SMILES for 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine is Clc1nc(N2CCOCC2)c2oc(C3CCNC3)cc2n1.
What is the InChIKey of 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine?
The InChIKey is QKWTUBYYXUWWCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN4O2/c15-14-17-10-7-11(9-1-2-16-8-9)21-12(10)13(18-14)19-3-5-20-6-4-19/h7,9,16H,1-6,8H2.
What are the key properties of 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine?
2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine has a molecular weight of 308.77 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-morpholin-4-yl-6-pyrrolidin-3-ylfuro[3,2-d]pyrimidine is sourced from PubChem (CID 166164483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).