N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine

C15H31N3O — CID 62591322

IUPACN-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine
SMILESCC(C)NCC1CCN(CCN2CCOCC2)CC1
InChIInChI=1S/C15H31N3O/c1-14(2)16-13-15-3-5-17(6-4-15)7-8-18-9-11-19-12-10-18/h14-16H,3-13H2,1-2H3
InChIKeyMPOCHAVDQBLBQZ-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.03
Rot. Bonds6

About N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine

N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine (PubChem CID 62591322) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine
PubChem CID62591322
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine
SMILESCC(C)NCC1CCN(CCN2CCOCC2)CC1
InChIInChI=1S/C15H31N3O/c1-14(2)16-13-15-3-5-17(6-4-15)7-8-18-9-11-19-12-10-18/h14-16H,3-13H2,1-2H3
InChIKeyMPOCHAVDQBLBQZ-UHFFFAOYSA-N
XLogP1.03
TPSA27.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methanamine;dihydrochloride
CID 119922597
N-[(1-heptylpiperidin-4-yl)methyl]propan-2-amine
CID 62591501
N-[[1-(3-methylbut-3-enyl)piperidin-4-yl]methyl]propan-2-amine
CID 114476807
N-[[1-[3-(2-methoxyethoxy)propyl]piperidin-4-yl]methyl]propan-2-amine
CID 103410145
N-[[1-[2-(2-methylimidazol-1-yl)ethyl]piperidin-4-yl]methyl]propan-2-amine
CID 62592921
N-(morpholin-4-ylmethyl)propan-2-amine
CID 59379058
N-[[1-(2-phenoxyethyl)piperidin-4-yl]methyl]propan-2-amine
CID 62593626
2,2-dimethyl-5-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]pentanenitrile
CID 65255387
N-[[1-(2-bromoprop-2-enyl)piperidin-4-yl]methyl]propan-2-amine
CID 63849110
(1R)-1-cyclopentyl-N-(2-morpholin-4-ylethyl)ethanamine
CID 81394367
4-[2-[4-(bromomethyl)piperidin-1-yl]ethyl]morpholine
CID 80675433
N-methyl-1-(2-morpholin-4-ylethyl)piperidin-4-amine
CID 60819990

Frequently Asked Questions

What is the IUPAC name of N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine (CID 62591322) is N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine is CC(C)NCC1CCN(CCN2CCOCC2)CC1.
What is the InChIKey of N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine?
The InChIKey is MPOCHAVDQBLBQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-14(2)16-13-15-3-5-17(6-4-15)7-8-18-9-11-19-12-10-18/h14-16H,3-13H2,1-2H3.
What are the key properties of N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine?
N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine has a molecular weight of 269.43 g/mol, XLogP of 1.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2-morpholin-4-ylethyl)piperidin-4-yl]methyl]propan-2-amine is sourced from PubChem (CID 62591322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).