N,N-di(propan-2-yl)thiolan-3-amine

C10H21NS — CID 22975545

IUPACN,N-di(propan-2-yl)thiolan-3-amine
SMILESCC(C)N(C(C)C)C1CCSC1
InChIInChI=1S/C10H21NS/c1-8(2)11(9(3)4)10-5-6-12-7-10/h8-10H,5-7H2,1-4H3
InChIKeyDNWRJNAPLWTMSD-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.61
Rot. Bonds3

About N,N-di(propan-2-yl)thiolan-3-amine

N,N-di(propan-2-yl)thiolan-3-amine (PubChem CID 22975545) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is N,N-di(propan-2-yl)thiolan-3-amine.

Molecular Properties

Compound NameN,N-di(propan-2-yl)thiolan-3-amine
PubChem CID22975545
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC NameN,N-di(propan-2-yl)thiolan-3-amine
SMILESCC(C)N(C(C)C)C1CCSC1
InChIInChI=1S/C10H21NS/c1-8(2)11(9(3)4)10-5-6-12-7-10/h8-10H,5-7H2,1-4H3
InChIKeyDNWRJNAPLWTMSD-UHFFFAOYSA-N
XLogP2.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)thiolan-3-amine?
The IUPAC name of N,N-di(propan-2-yl)thiolan-3-amine (CID 22975545) is N,N-di(propan-2-yl)thiolan-3-amine.
What is the SMILES notation for N,N-di(propan-2-yl)thiolan-3-amine?
The canonical SMILES for N,N-di(propan-2-yl)thiolan-3-amine is CC(C)N(C(C)C)C1CCSC1.
What is the InChIKey of N,N-di(propan-2-yl)thiolan-3-amine?
The InChIKey is DNWRJNAPLWTMSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NS/c1-8(2)11(9(3)4)10-5-6-12-7-10/h8-10H,5-7H2,1-4H3.
What are the key properties of N,N-di(propan-2-yl)thiolan-3-amine?
N,N-di(propan-2-yl)thiolan-3-amine has a molecular weight of 187.35 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)thiolan-3-amine is sourced from PubChem (CID 22975545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).