4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine

C16H25N3S — CID 63915986

IUPAC4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine
SMILESCC(C1CC1)N(C)c1nc(C2CC2)c(CNC2CC2)s1
InChIInChI=1S/C16H25N3S/c1-10(11-3-4-11)19(2)16-18-15(12-5-6-12)14(20-16)9-17-13-7-8-13/h10-13,17H,3-9H2,1-2H3
InChIKeyYXQMIZOGYIANAT-UHFFFAOYSA-N
MW291.46 g/mol
LogP3.51
Rot. Bonds7

About 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine

4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine (PubChem CID 63915986) has the molecular formula C16H25N3S and a molecular weight of 291.46 g/mol. Its IUPAC name is 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine
PubChem CID63915986
Molecular FormulaC16H25N3S
Molecular Weight291.46 g/mol
Exact Mass291.18
IUPAC Name4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine
SMILESCC(C1CC1)N(C)c1nc(C2CC2)c(CNC2CC2)s1
InChIInChI=1S/C16H25N3S/c1-10(11-3-4-11)19(2)16-18-15(12-5-6-12)14(20-16)9-17-13-7-8-13/h10-13,17H,3-9H2,1-2H3
InChIKeyYXQMIZOGYIANAT-UHFFFAOYSA-N
XLogP3.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.46
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopropyl-N-(1-cyclopropylethyl)-N-methyl-5-(methylaminomethyl)-1,3-thiazol-2-amine
CID 63915790
5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine
CID 79395527
4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-methyl-N-pentyl-1,3-thiazol-2-amine
CID 63916176
4-cyclopropyl-N-methyl-N-(3-methylbutan-2-yl)-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 63916185
4-cyclopropyl-5-(ethylaminomethyl)-N-methyl-N-pentan-2-yl-1,3-thiazol-2-amine
CID 63918125
4-cyclopropyl-5-(ethylaminomethyl)-N-methyl-N-(4-methylpentan-2-yl)-1,3-thiazol-2-amine
CID 63918356
N-[(4-cyclopropyl-2-methyl-1,3-thiazol-5-yl)methyl]cyclopentanamine
CID 82435835
4-cyclopropyl-5-[(cyclopropylamino)methyl]-1,3-thiazol-2-amine
CID 114367607
4-cyclopropyl-N-methyl-N-(1-methylsulfanylpropan-2-yl)-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 115987992
N-[[4-cyclopropyl-2-(2-methoxypropyl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 114367731
N-(1-cyclopropylethyl)-4-ethyl-N-methyl-5-[(propan-2-ylamino)methyl]-1,3-thiazol-2-amine
CID 62768154
N-[[4-cyclopropyl-2-(4-methylcyclohexyl)-1,3-thiazol-5-yl]methyl]cyclopropanamine
CID 114367712

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine?
The IUPAC name of 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine (CID 63915986) is 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine is CC(C1CC1)N(C)c1nc(C2CC2)c(CNC2CC2)s1.
What is the InChIKey of 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine?
The InChIKey is YXQMIZOGYIANAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3S/c1-10(11-3-4-11)19(2)16-18-15(12-5-6-12)14(20-16)9-17-13-7-8-13/h10-13,17H,3-9H2,1-2H3.
What are the key properties of 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine?
4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine has a molecular weight of 291.46 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(1-cyclopropylethyl)-N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 63915986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).