N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine

C14H21NS — CID 115898671

IUPACN-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine
SMILESCCCC1CC1NC(c1cccs1)C1CC1
InChIInChI=1S/C14H21NS/c1-2-4-11-9-12(11)15-14(10-6-7-10)13-5-3-8-16-13/h3,5,8,10-12,14-15H,2,4,6-7,9H2,1H3
InChIKeyQJAOFNHRSUFHMY-UHFFFAOYSA-N
MW235.40 g/mol
LogP3.98
Rot. Bonds6

About N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine

N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine (PubChem CID 115898671) has the molecular formula C14H21NS and a molecular weight of 235.40 g/mol. Its IUPAC name is N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine
PubChem CID115898671
Molecular FormulaC14H21NS
Molecular Weight235.40 g/mol
Exact Mass235.14
IUPAC NameN-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine
SMILESCCCC1CC1NC(c1cccs1)C1CC1
InChIInChI=1S/C14H21NS/c1-2-4-11-9-12(11)15-14(10-6-7-10)13-5-3-8-16-13/h3,5,8,10-12,14-15H,2,4,6-7,9H2,1H3
InChIKeyQJAOFNHRSUFHMY-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.40
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Benzyl(1-(thiophen-2-yl)propan-2-yl)amine
CID 4868418
N-[(3-methylthiophen-2-yl)methyl]cyclohexanamine
CID 4721499
2-Methyl-1-thiophen-2-yl-propylamine
CID 3159240
4-cyclopropyl-4H,5H,6H,7H-thieno(3,2-c)pyridine
CID 6485297
2-(Thiophen-2-yl)pyrrolidine
CID 339554
Dipropyl-((1S,2S)-2-thiophen-2-yl-cyclopropyl)-amine
CID 10609150
Dipropyl-((1R,2R)-2-thiophen-2-yl-cyclopropyl)-amine
CID 10632876
N'-[3-(thiophen-2-ylmethylamino)propyl]octane-1,8-diamine
CID 76324403
2-Thiophenemethanamine, N-ethyl-alpha-(phenylmethyl)-, hydrochloride (1:1)
CID 3061989
Methyl[1-(thiophen-2-yl)ethyl]amine
CID 458576
2-[[(1-Phenylethyl)amino]methyl]-5-methylthiophene
CID 4715520
7-Isopropyl-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine
CID 14548170

Frequently Asked Questions

What is the IUPAC name of N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine?
The IUPAC name of N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine (CID 115898671) is N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine.
What is the SMILES notation for N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine?
The canonical SMILES for N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine is CCCC1CC1NC(c1cccs1)C1CC1.
What is the InChIKey of N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine?
The InChIKey is QJAOFNHRSUFHMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NS/c1-2-4-11-9-12(11)15-14(10-6-7-10)13-5-3-8-16-13/h3,5,8,10-12,14-15H,2,4,6-7,9H2,1H3.
What are the key properties of N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine?
N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine has a molecular weight of 235.40 g/mol, XLogP of 3.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopropyl(thiophen-2-yl)methyl]-2-propylcyclopropan-1-amine is sourced from PubChem (CID 115898671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).