N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine

C14H23NS — CID 62712088

IUPACN-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine
SMILESCCC1(c2cccs2)CC1CNC(C)(C)C
InChIInChI=1S/C14H23NS/c1-5-14(12-7-6-8-16-12)9-11(14)10-15-13(2,3)4/h6-8,11,15H,5,9-10H2,1-4H3
InChIKeyRZNIEPWBTRCKCM-UHFFFAOYSA-N
MW237.41 g/mol
LogP3.80
Rot. Bonds4

About N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine

N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine (PubChem CID 62712088) has the molecular formula C14H23NS and a molecular weight of 237.41 g/mol. Its IUPAC name is N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine
PubChem CID62712088
Molecular FormulaC14H23NS
Molecular Weight237.41 g/mol
Exact Mass237.16
IUPAC NameN-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine
SMILESCCC1(c2cccs2)CC1CNC(C)(C)C
InChIInChI=1S/C14H23NS/c1-5-14(12-7-6-8-16-12)9-11(14)10-15-13(2,3)4/h6-8,11,15H,5,9-10H2,1-4H3
InChIKeyRZNIEPWBTRCKCM-UHFFFAOYSA-N
XLogP3.80
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.41
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]propan-1-amine
CID 62708367
N-[(2-methyl-2-thiophen-2-ylcyclopropyl)methyl]propan-1-amine
CID 62708007
N-[[2-(5-bromothiophen-2-yl)-2-methylcyclopropyl]methyl]-2-methylpropan-2-amine
CID 62712086
N-[(3-tert-butyl-1-thiophen-2-ylcyclobutyl)methyl]propan-1-amine
CID 65014479
N-[(4,4-dimethyl-2-thiophen-2-ylcyclohexyl)methyl]-2-methylpropan-2-amine
CID 81030814
N-[(2-ethyl-2-methylcyclopropyl)methyl]-2-methylpropan-2-amine
CID 62712630
2-propyl-1-thiophen-2-ylcyclopropan-1-ol
CID 79332590
(3-ethyl-1-thiophen-2-ylcyclobutyl)methanamine
CID 65000256
N-[(2-propan-2-yl-2-thiophen-2-ylcyclopropyl)methyl]propan-2-amine
CID 62708952
N-[[4,4-dimethyl-2-(2-thiophen-2-ylethyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 81022477
2-methyl-N-[[1-(thiophen-2-ylmethyl)piperidin-4-yl]methyl]propan-2-amine
CID 62591872
N-[(3-propyl-1-thiophen-2-ylcyclobutyl)methyl]cyclopropanamine
CID 65014158

Frequently Asked Questions

What is the IUPAC name of N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine (CID 62712088) is N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine is CCC1(c2cccs2)CC1CNC(C)(C)C.
What is the InChIKey of N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine?
The InChIKey is RZNIEPWBTRCKCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NS/c1-5-14(12-7-6-8-16-12)9-11(14)10-15-13(2,3)4/h6-8,11,15H,5,9-10H2,1-4H3.
What are the key properties of N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine?
N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine has a molecular weight of 237.41 g/mol, XLogP of 3.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethyl-2-thiophen-2-ylcyclopropyl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62712088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).