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N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine

C15H26N2O — CID 62418553

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPACN-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
SMILESCc1cc(CN(C)C2CC2)oc1CNCC(C)C
InChIInChI=1S/C15H26N2O/c1-11(2)8-16-9-15-12(3)7-14(18-15)10-17(4)13-5-6-13/h7,11,13,16H,5-6,8-10H2,1-4H3
InChIKeyFCWQYJDWWJJFRF-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.93
Rot. Bonds7

About N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine

N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine (PubChem CID 62418553) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
PubChem CID62418553
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC NameN-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine
SMILESCc1cc(CN(C)C2CC2)oc1CNCC(C)C
InChIInChI=1S/C15H26N2O/c1-11(2)8-16-9-15-12(3)7-14(18-15)10-17(4)13-5-6-13/h7,11,13,16H,5-6,8-10H2,1-4H3
InChIKeyFCWQYJDWWJJFRF-UHFFFAOYSA-N
XLogP2.93
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine (CID 62418553) is N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine is Cc1cc(CN(C)C2CC2)oc1CNCC(C)C.
What is the InChIKey of N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
The InChIKey is FCWQYJDWWJJFRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-11(2)8-16-9-15-12(3)7-14(18-15)10-17(4)13-5-6-13/h7,11,13,16H,5-6,8-10H2,1-4H3.
What are the key properties of N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine?
N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine has a molecular weight of 250.39 g/mol, XLogP of 2.93, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[4-methyl-5-[(2-methylpropylamino)methyl]furan-2-yl]methyl]cyclopropanamine is sourced from PubChem (CID 62418553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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