N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine

C10H11N3S — CID 43112087

IUPACN-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESc1nc(NCC2CC2)c2ccsc2n1
InChIInChI=1S/C10H11N3S/c1-2-7(1)5-11-9-8-3-4-14-10(8)13-6-12-9/h3-4,6-7H,1-2,5H2,(H,11,12,13)
InChIKeyGQMKWVBNMPYIDF-UHFFFAOYSA-N
MW205.29 g/mol
LogP2.51
Rot. Bonds3

About N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine

N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 43112087) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID43112087
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC NameN-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESc1nc(NCC2CC2)c2ccsc2n1
InChIInChI=1S/C10H11N3S/c1-2-7(1)5-11-9-8-3-4-14-10(8)13-6-12-9/h3-4,6-7H,1-2,5H2,(H,11,12,13)
InChIKeyGQMKWVBNMPYIDF-UHFFFAOYSA-N
XLogP2.51
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-{Thieno[2,3-d]pyrimidin-4-yl}piperazine
CID 16768198
4-Aminothieno(2,3-d)pyrimidine
CID 4269486
N-(cyclopropylmethyl)-N-propyl-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide
CID 2373458
N-butan-2-yl-2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetamide
CID 3385586
N-(2-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 3469075
[Phosphono-(thieno[2,3-d]pyrimidin-4-ylamino)methyl]phosphonic acid
CID 71583204
2-Methyl-4-pyrrolidin-1-ylthieno[2,3-d]pyrimidine
CID 2139595
1-[3-(Thieno[2,3-d]pyrimidin-4-ylamino)propyl]pyrrolidin-2-one
CID 5161259
N,N-diethylthieno[2,3-d]pyrimidin-4-amine
CID 2808589
5-methyl-N-propylthieno[2,3-d]pyrimidin-4-amine
CID 44379610
4-N,4-N-dimethyl-1-N-thieno[2,3-d]pyrimidin-4-ylcyclohexane-1,4-diamine
CID 117826679
Thieno(2,3-d)pyrimidine, 4-(4-methyl-1-piperazinyl)-, hydrochloride
CID 216792

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine (CID 43112087) is N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine is c1nc(NCC2CC2)c2ccsc2n1.
What is the InChIKey of N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is GQMKWVBNMPYIDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-2-7(1)5-11-9-8-3-4-14-10(8)13-6-12-9/h3-4,6-7H,1-2,5H2,(H,11,12,13).
What are the key properties of N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine?
N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 205.29 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 43112087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).