N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine

C15H22N4S — CID 143957177

IUPACN-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1csc2ncnc(NC3CCC(CCN)CC3)c12
InChIInChI=1S/C15H22N4S/c1-10-8-20-15-13(10)14(17-9-18-15)19-12-4-2-11(3-5-12)6-7-16/h8-9,11-12H,2-7,16H2,1H3,(H,17,18,19)
InChIKeyAVMROSAGSPGUML-UHFFFAOYSA-N
MW290.44 g/mol
LogP3.32
Rot. Bonds4

About N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine

N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 143957177) has the molecular formula C15H22N4S and a molecular weight of 290.44 g/mol. Its IUPAC name is N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound NameN-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID143957177
Molecular FormulaC15H22N4S
Molecular Weight290.44 g/mol
Exact Mass290.16
IUPAC NameN-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCc1csc2ncnc(NC3CCC(CCN)CC3)c12
InChIInChI=1S/C15H22N4S/c1-10-8-20-15-13(10)14(17-9-18-15)19-12-4-2-11(3-5-12)6-7-16/h8-9,11-12H,2-7,16H2,1H3,(H,17,18,19)
InChIKeyAVMROSAGSPGUML-UHFFFAOYSA-N
XLogP3.32
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.44
LogP ≤ 53.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylcyclohexyl)-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 59232479
4-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]cyclohexan-1-ol
CID 123828664
N-[4-[2-(dimethylamino)ethoxy]cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 143957207
N-[4-(2-aminoethyl)cyclohexyl]quinazolin-4-amine
CID 143957231
sodium 2-[(5-methylthieno[2,3-d]pyrimidin-4-yl)amino]-2,3-dihydro-1H-indene-5-carboxylic acid
CID 22719601
4-N-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)cyclohexane-1,4-diamine
CID 62318881
4-N-(7-methylthieno[3,2-d]pyrimidin-4-yl)cyclohexane-1,4-diamine
CID 102686178
N-[2-(1,1-dioxothiolan-3-yl)oxyethyl]-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 167931389
N-benzyl-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 68604925
N-(2-cyclopentyloxyphenyl)-5-methylthieno[2,3-d]pyrimidin-4-amine
CID 15985925
6-chloro-4-N-(4-propylcyclohexyl)pyrimidine-4,5-diamine
CID 55143310
5-ethyl-4-N-(4-propylcyclohexyl)pyrimidine-4,6-diamine
CID 80807733

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine (CID 143957177) is N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine is Cc1csc2ncnc(NC3CCC(CCN)CC3)c12.
What is the InChIKey of N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is AVMROSAGSPGUML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4S/c1-10-8-20-15-13(10)14(17-9-18-15)19-12-4-2-11(3-5-12)6-7-16/h8-9,11-12H,2-7,16H2,1H3,(H,17,18,19).
What are the key properties of N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine?
N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 290.44 g/mol, XLogP of 3.32, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-aminoethyl)cyclohexyl]-5-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 143957177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).