(4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine

C14H22N2OS — CID 79247120

IUPAC(4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(CCc1ccco1)NC1=N[C@@H](C(C)C)CS1
InChIInChI=1S/C14H22N2OS/c1-10(2)13-9-18-14(16-13)15-11(3)6-7-12-5-4-8-17-12/h4-5,8,10-11,13H,6-7,9H2,1-3H3,(H,15,16)/t11?,13-/m1/s1
InChIKeyFEPSFJVXWRCOAL-GLGOKHISSA-N
MW266.41 g/mol
LogP3.32
Rot. Bonds5

About (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine

(4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 79247120) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound Name(4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID79247120
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name(4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC(CCc1ccco1)NC1=N[C@@H](C(C)C)CS1
InChIInChI=1S/C14H22N2OS/c1-10(2)13-9-18-14(16-13)15-11(3)6-7-12-5-4-8-17-12/h4-5,8,10-11,13H,6-7,9H2,1-3H3,(H,15,16)/t11?,13-/m1/s1
InChIKeyFEPSFJVXWRCOAL-GLGOKHISSA-N
XLogP3.32
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine with MolForge

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Related Compounds

6-chloro-2-N-[4-(furan-2-yl)butan-2-yl]-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80804357
4-ethyl-N-[4-(furan-2-yl)butan-2-yl]-1,3-thiazol-2-amine
CID 62961372
N-[4-(furan-2-yl)butan-2-yl]-4,5-dihydro-1H-imidazol-2-amine
CID 115601215
N-[4-(furan-2-yl)butan-2-yl]pyridazin-3-amine
CID 62482242
N-[4-(furan-2-yl)butan-2-yl]-4,6-dimethoxy-1,3,5-triazin-2-amine
CID 62860172
N-[4-(furan-2-yl)butan-2-yl]acridin-9-amine
CID 4516381
2-N-[4-(furan-2-yl)butan-2-yl]-6-methoxy-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80804354
N-[4-(furan-2-yl)butan-2-yl]-5-(methylaminomethyl)-1,3,4-oxadiazol-2-amine
CID 106959609
N-butyl-4-(furan-2-yl)butan-2-amine
CID 43182419
2-cyclopropyl-4-N-[4-(furan-2-yl)butan-2-yl]pyrimidine-4,6-diamine
CID 80962005
N-[4-(furan-2-yl)butan-2-yl]-4-propylaniline
CID 43478896
N-[4-(furan-2-yl)butan-2-yl]-2-methylquinolin-4-amine
CID 60716310

Frequently Asked Questions

What is the IUPAC name of (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine (CID 79247120) is (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine is CC(CCc1ccco1)NC1=N[C@@H](C(C)C)CS1.
What is the InChIKey of (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is FEPSFJVXWRCOAL-GLGOKHISSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-10(2)13-9-18-14(16-13)15-11(3)6-7-12-5-4-8-17-12/h4-5,8,10-11,13H,6-7,9H2,1-3H3,(H,15,16)/t11?,13-/m1/s1.
What are the key properties of (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine?
(4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 266.41 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-[4-(furan-2-yl)butan-2-yl]-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 79247120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).