N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine

C15H20N4OS — CID 102952840

IUPACN-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
SMILESCCCc1nc(-c2cc(OC)ncn2)sc1CNC1CC1
InChIInChI=1S/C15H20N4OS/c1-3-4-11-13(8-16-10-5-6-10)21-15(19-11)12-7-14(20-2)18-9-17-12/h7,9-10,16H,3-6,8H2,1-2H3
InChIKeyUBANKQUTDCLXNS-UHFFFAOYSA-N
MW304.42 g/mol
LogP2.81
Rot. Bonds7

About N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine

N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine (PubChem CID 102952840) has the molecular formula C15H20N4OS and a molecular weight of 304.42 g/mol. Its IUPAC name is N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
PubChem CID102952840
Molecular FormulaC15H20N4OS
Molecular Weight304.42 g/mol
Exact Mass304.14
IUPAC NameN-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
SMILESCCCc1nc(-c2cc(OC)ncn2)sc1CNC1CC1
InChIInChI=1S/C15H20N4OS/c1-3-4-11-13(8-16-10-5-6-10)21-15(19-11)12-7-14(20-2)18-9-17-12/h7,9-10,16H,3-6,8H2,1-2H3
InChIKeyUBANKQUTDCLXNS-UHFFFAOYSA-N
XLogP2.81
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.42
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine with MolForge

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Launch Full Analysis

Related Compounds

N-[[4-ethyl-2-(6-methoxypyrimidin-4-yl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 102952823
1-[2-(6-methoxypyrimidin-4-yl)-4-methyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 102952808
N-[[4-cyclopropyl-2-(6-methoxypyrimidin-4-yl)-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 102952854
N-[[3-(6-methoxypyrimidin-4-yl)-1,2,4-oxadiazol-5-yl]methyl]cyclopropanamine
CID 102949634
1-[2-(6-methoxypyrimidin-4-yl)-4-propan-2-yl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 102952841
1-[2-(6-methoxypyridazin-3-yl)-4-propyl-1,3-thiazol-5-yl]-N-methylmethanamine
CID 103375123
N-[[2-(3-ethyl-4-pyridinyl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 114364454
N-[[4-(methoxymethyl)-2-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 82440145
N-[[2-[2-(dimethylamino)ethyl]-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 82433073
2-methyl-N-[[2-(4-methyl-2-pyridinyl)-4-propyl-1,3-thiazol-5-yl]methyl]propan-2-amine
CID 114364678
N-[(4-ethyl-2-pyridin-2-yl-1,3-thiazol-5-yl)methyl]cyclopentanamine
CID 82428658
N-[[2-(3-methylbutyl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 114364385

Frequently Asked Questions

What is the IUPAC name of N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine (CID 102952840) is N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine is CCCc1nc(-c2cc(OC)ncn2)sc1CNC1CC1.
What is the InChIKey of N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine?
The InChIKey is UBANKQUTDCLXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4OS/c1-3-4-11-13(8-16-10-5-6-10)21-15(19-11)12-7-14(20-2)18-9-17-12/h7,9-10,16H,3-6,8H2,1-2H3.
What are the key properties of N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine?
N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine has a molecular weight of 304.42 g/mol, XLogP of 2.81, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(6-methoxypyrimidin-4-yl)-4-propyl-1,3-thiazol-5-yl]methyl]cyclopropanamine is sourced from PubChem (CID 102952840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).