trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine

C8H18N2 — CID 23423010

IUPACtrans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine
SMILESCN(C)C[C@@H]1CCC[C@@H]1N
InChIInChI=1S/C8H18N2/c1-10(2)6-7-4-3-5-8(7)9/h7-8H,3-6,9H2,1-2H3/t7-,8-/m0/s1
InChIKeyDPRDFTIGFKZCPX-YUMQZZPRSA-N
MW142.25 g/mol
LogP0.68
Rot. Bonds2

About trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine

trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine (PubChem CID 23423010) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine.

Molecular Properties

Compound Nametrans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine
PubChem CID23423010
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Nametrans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine
SMILESCN(C)C[C@@H]1CCC[C@@H]1N
InChIInChI=1S/C8H18N2/c1-10(2)6-7-4-3-5-8(7)9/h7-8H,3-6,9H2,1-2H3/t7-,8-/m0/s1
InChIKeyDPRDFTIGFKZCPX-YUMQZZPRSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine?
The IUPAC name of trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine (CID 23423010) is trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine.
What is the SMILES notation for trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine?
The canonical SMILES for trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine is CN(C)C[C@@H]1CCC[C@@H]1N.
What is the InChIKey of trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine?
The InChIKey is DPRDFTIGFKZCPX-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H18N2/c1-10(2)6-7-4-3-5-8(7)9/h7-8H,3-6,9H2,1-2H3/t7-,8-/m0/s1.
What are the key properties of trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine?
trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine has a molecular weight of 142.25 g/mol, XLogP of 0.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2S)-2-[(dimethylamino)methyl]cyclopentan-1-amine is sourced from PubChem (CID 23423010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).