N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine

C14H24N2O — CID 128998062

IUPACN-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
SMILESCC(C)[C@H]1OCC[C@@H]1CNCc1cccn1C
InChIInChI=1S/C14H24N2O/c1-11(2)14-12(6-8-17-14)9-15-10-13-5-4-7-16(13)3/h4-5,7,11-12,14-15H,6,8-10H2,1-3H3/t12-,14-/m1/s1
InChIKeyFCNXDQPOAYVXDJ-TZMCWYRMSA-N
MW236.36 g/mol
LogP2.18
Rot. Bonds5

About N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine

N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine (PubChem CID 128998062) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine.

Molecular Properties

Compound NameN-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
PubChem CID128998062
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
SMILESCC(C)[C@H]1OCC[C@@H]1CNCc1cccn1C
InChIInChI=1S/C14H24N2O/c1-11(2)14-12(6-8-17-14)9-15-10-13-5-4-7-16(13)3/h4-5,7,11-12,14-15H,6,8-10H2,1-3H3/t12-,14-/m1/s1
InChIKeyFCNXDQPOAYVXDJ-TZMCWYRMSA-N
XLogP2.18
TPSA26.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine with MolForge

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Related Compounds

1-[(2R,3S)-2-(1-methylpyrazol-4-yl)oxolan-3-yl]-N-[(1-methylpyrrol-2-yl)methyl]methanamine
CID 97075757
4-[[(1-methylpyrrol-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 106126325
N-(furan-2-ylmethyl)-1-(2-propan-2-yloxolan-3-yl)methanamine
CID 115677915
N-[(5-ethylfuran-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
CID 129000253
N-[(2-methyl-3-pyridinyl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
CID 129005157
1-(3-methylcyclopentyl)-N-[(1-methylpyrrol-2-yl)methyl]methanamine
CID 107412144
3-[[(2-propan-2-yloxolan-3-yl)methylamino]methyl]benzoic acid
CID 122031730
3-[[[(2R,3R)-2-propan-2-yloxolan-3-yl]methylamino]methyl]benzamide
CID 128993203
N-[(4-methyl-1,3-thiazol-5-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
CID 129003995
N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine
CID 129000274
2-[[(1-methylpyrrol-2-yl)methylamino]methyl]-4-(4-methyl-1,2,4-triazol-3-yl)cyclopentan-1-ol
CID 171735379
2-methyl-N-[(2-propan-2-yloxolan-3-yl)methyl]butan-1-amine
CID 115887817

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine?
The IUPAC name of N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine (CID 128998062) is N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine.
What is the SMILES notation for N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine?
The canonical SMILES for N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine is CC(C)[C@H]1OCC[C@@H]1CNCc1cccn1C.
What is the InChIKey of N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine?
The InChIKey is FCNXDQPOAYVXDJ-TZMCWYRMSA-N. The full InChI is InChI=1S/C14H24N2O/c1-11(2)14-12(6-8-17-14)9-15-10-13-5-4-7-16(13)3/h4-5,7,11-12,14-15H,6,8-10H2,1-3H3/t12-,14-/m1/s1.
What are the key properties of N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine?
N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine has a molecular weight of 236.36 g/mol, XLogP of 2.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylpyrrol-2-yl)methyl]-1-[(2R,3R)-2-propan-2-yloxolan-3-yl]methanamine is sourced from PubChem (CID 128998062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).